Starting installation of Amber9 (serial) at Fri Nov 24 16:23:19 EST 2006. cd lib; make install make[1]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P new2oldparm.f > _new2oldparm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o new2oldparm.o _new2oldparm.f pathf90 -cpp -E -P nxtsec.f > _nxtsec.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o nxtsec.o _nxtsec.f pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o new2oldparm new2oldparm.o nxtsec.o pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead mv new2oldparm ../../exe /bin/rm _*.f make[1]: Leaving directory `/usr/local/amber9/src/lib' cd addles; make install make[1]: Entering directory `/usr/local/amber9/src/addles' pathf90 -cpp -E -P lesmain.f > _lesmain.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o lesmain.o _lesmain.f pathf90 -cpp -E -P addspace.f > _addspace.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o addspace.o _addspace.f pathf90 -cpp -E -P readprm.f > _readprm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o readprm.o _readprm.f pathf90 -cpp -E -P writprm.f > _writprm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o writprm.o _writprm.f pathf90 -cpp -E -P readcrd.f > _readcrd.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o readcrd.o _readcrd.f pathf90 -cpp -E -P writcrd.f > _writcrd.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o writcrd.o _writcrd.f pathf90 -cpp -E -P pick.f > _pick.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o pick.o _pick.f pathf90 -cpp -E -P rline.f > _rline.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o rline.o _rline.f pathf90 -cpp -E -P nxt.f > _nxt.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o nxt.o _nxt.f pathf90 -cpp -E -P intgr.f > _intgr.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o intgr.o _intgr.f pathf90 -cpp -E -P find.f > _find.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o find.o _find.f pathf90 -cpp -E -P of.f > _of.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o of.o _of.f pathf90 -cpp -E -P geti.f > _geti.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o geti.o _geti.f pathf90 -cpp -E -P unit.f > _unit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o unit.o _unit.f pathf90 -cpp -E -P getc.f > _getc.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o getc.o _getc.f pathf90 -cpp -E -P alert.f > _alert.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o alert.o _alert.f pathf90 -cpp -E -P echo.f > _echo.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o echo.o _echo.f pathf90 -cpp -E -P get4c.f > _get4c.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o get4c.o _get4c.f pathf90 -cpp -E -P getd.f > _getd.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o getd.o _getd.f pathf90 -cpp -E -P wlesprm.f > _wlesprm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o wlesprm.o _wlesprm.f pathf90 -cpp -E -P lesprm.f > _lesprm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o lesprm.o _lesprm.f pathf90 -cpp -E -P les2prm.f > _les2prm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o les2prm.o _les2prm.f pathf90 -cpp -E -P checksz.f > _checksz.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o checksz.o _checksz.f cd ../lib; ./Makelist ../lib/random.o ../lib/mexit.o ../lib/nxtsec.o make[2]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P random.f > _random.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o random.o _random.f make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P mexit.f > _mexit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o mexit.o _mexit.f make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `nxtsec.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o addles lesmain.o addspace.o readprm.o writprm.o readcrd.o writcrd.o pick.o rline.o nxt.o intgr.o find.o of.o geti.o unit.o getc.o alert.o echo.o get4c.o getd.o wlesprm.o lesprm.o les2prm.o checksz.o ../lib/random.o ../lib/mexit.o ../lib/nxtsec.o pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead mv addles ../../exe make[1]: Leaving directory `/usr/local/amber9/src/addles' cd sander; make serial make[1]: Entering directory `/usr/local/amber9/src/sander' ./checkserconf pathf90 -cpp -E -P evb_vars.f > _evb_vars.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_vars.o _evb_vars.f pathf90 -cpp -E -P evb_input.f > _evb_input.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_input.o _evb_input.f pathf90 -cpp -E -P evb_init.f > _evb_init.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_init.o _evb_init.f pathf90 -cpp -E -P evb_alloc.f > _evb_alloc.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_alloc.o _evb_alloc.f pathf90 -cpp -E -P evb_dealloc.f > _evb_dealloc.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_dealloc.o _evb_dealloc.f pathf90 -cpp -E -P check_input.f > _check_input.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o check_input.o _check_input.f pathf90 -cpp -E -P evb_io.f > _evb_io.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_io.o _evb_io.f pathf90 -cpp -E -P evb_keywrd.f > _evb_keywrd.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_keywrd.o _evb_keywrd.f pathf90 -cpp -E -P exchange_CM.f > _exchange_CM.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o exchange_CM.o _exchange_CM.f pathf90 -cpp -E -P evb_mcp.f > _evb_mcp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_mcp.o _evb_mcp.f pathf90 -cpp -E -P evb_force.f > _evb_force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_force.o _evb_force.f pathf90 -cpp -E -P diabatic.f > _diabatic.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o diabatic.o _diabatic.f pathf90 -cpp -E -P evb_2stdebug.f > _evb_2stdebug.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_2stdebug.o _evb_2stdebug.f pathf90 -cpp -E -P egap_umb_2stdebug.f > _egap_umb_2stdebug.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o egap_umb_2stdebug.o _egap_umb_2stdebug.f pathf90 -cpp -E -P exchange_gauss.f > _exchange_gauss.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o exchange_gauss.o _exchange_gauss.f pathf90 -cpp -E -P exchange_warshel.f > _exchange_warshel.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o exchange_warshel.o _exchange_warshel.f pathf90 -cpp -E -P parms.f > _parms.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o parms.o _parms.f pathf90 -cpp -E -P morsify.f > _morsify.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o morsify.o _morsify.f pathf90 -cpp -E -P morse_anal2num.f > _morse_anal2num.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o morse_anal2num.o _morse_anal2num.f pathf90 -cpp -E -P evb_pimd_init.f > _evb_pimd_init.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_pimd_init.o _evb_pimd_init.f pathf90 -cpp -E -P evb_matrix.f > _evb_matrix.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_matrix.o _evb_matrix.f pathf90 -cpp -E -P evb_ntrfc.f > _evb_ntrfc.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_ntrfc.o _evb_ntrfc.f pathf90 -cpp -E -P out_evb.f > _out_evb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o out_evb.o _out_evb.f pathf90 -cpp -E -P constants.f > _constants.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o constants.o _constants.f pathf90 -cpp -E -P stack.f > _stack.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o stack.o _stack.f pathf90 -cpp -E -P findmask.f > _findmask.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o findmask.o _findmask.f pathf90 -cpp -E -P qmmm_module.f > _qmmm_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qmmm_module.o _qmmm_module.f pathf90 -cpp -E -P trace.f > _trace.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o trace.o _trace.f pathf90 -cpp -E -P lmod.f > _lmod.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o lmod.o _lmod.f pathf90 -cpp -E -P decomp.f > _decomp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o decomp.o _decomp.f pathf90 -cpp -E -P icosasurf.f > _icosasurf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o icosasurf.o _icosasurf.f pathf90 -cpp -E -P pimd_vars.f > _pimd_vars.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pimd_vars.o _pimd_vars.f pathf90 -cpp -E -P egb.f > _egb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o egb.o _egb.f pathf90 -cpp -E -P sa_driver.f > _sa_driver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o sa_driver.o _sa_driver.f pathf90 -cpp -E -P pb_force.f > _pb_force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pb_force.o _pb_force.f pathf90 -cpp -E -P pb_exmol.f > _pb_exmol.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pb_exmol.o _pb_exmol.f pathf90 -cpp -E -P pb_mpfrc.f > _pb_mpfrc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pb_mpfrc.o _pb_mpfrc.f pathf90 -cpp -E -P pb_direct.f > _pb_direct.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pb_direct.o _pb_direct.f pathf90 -cpp -E -P pb_list.f > _pb_list.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pb_list.o _pb_list.f pathf90 -cpp -E -P np_force.f > _np_force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o np_force.o _np_force.f pathf90 -cpp -E -P relax_mat.f > _relax_mat.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o relax_mat.o _relax_mat.f pathf90 -cpp -E -P nmr.f > _nmr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nmr.o _nmr.f pathf90 -cpp -E -P multisander.f > _multisander.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o multisander.o _multisander.f pathf90 -cpp -E -P fastwt.f > _fastwt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o fastwt.o _fastwt.f pathf90 -cpp -E -P nonbond_list.f > _nonbond_list.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nonbond_list.o _nonbond_list.f pathf90 -cpp -E -P ew_bspline.f > _ew_bspline.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_bspline.o _ew_bspline.f pathf90 -cpp -E -P ew_recip.f > _ew_recip.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_recip.o _ew_recip.f pathf90 -cpp -E -P amoeba_mdin.f > _amoeba_mdin.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_mdin.o _amoeba_mdin.f pathf90 -cpp -E -P amoeba_runmd.f > _amoeba_runmd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_runmd.o _amoeba_runmd.f pathf90 -cpp -E -P amoeba_multipoles.f > _amoeba_multipoles.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_multipoles.o _amoeba_multipoles.f data qind1 /1,2,3,1,1,2/ ^ pathf95-1542 pathf90: WARNING XFORM_MPOLE_MATRIX, File = _amoeba_multipoles.f, Line = 816, Column = 8 Initializing a named common block member in a program unit other than a block data is not legal for this architecture. data qind2 /1,2,3,2,3,3/ ^ pathf95-1542 pathf90: WARNING XFORM_MPOLE_MATRIX, File = _amoeba_multipoles.f, Line = 817, Column = 8 Initializing a named common block member in a program unit other than a block data is not legal for this architecture. data oind1 /1,2,3,1,1,2,2,3,3,1/ ^ pathf95-1542 pathf90: WARNING XFORM_MPOLE_MATRIX, File = _amoeba_multipoles.f, Line = 818, Column = 8 Initializing a named common block member in a program unit other than a block data is not legal for this architecture. data oind2 /1,2,3,1,1,2,2,3,3,2/ ^ pathf95-1542 pathf90: WARNING XFORM_MPOLE_MATRIX, File = _amoeba_multipoles.f, Line = 819, Column = 8 Initializing a named common block member in a program unit other than a block data is not legal for this architecture. data oind3 /1,2,3,2,3,1,3,1,2,3/ ^ pathf95-1542 pathf90: WARNING XFORM_MPOLE_MATRIX, File = _amoeba_multipoles.f, Line = 820, Column = 8 Initializing a named common block member in a program unit other than a block data is not legal for this architecture. data hind1 /1,2,3,1,1,2,2,3,3,1,1,2,1,2,3/ ^ pathf95-1542 pathf90: WARNING XFORM_MPOLE_MATRIX, File = _amoeba_multipoles.f, Line = 821, Column = 8 Initializing a named common block member in a program unit other than a block data is not legal for this architecture. data hind2 /1,2,3,1,1,2,2,3,3,1,1,2,1,2,3/ ^ pathf95-1542 pathf90: WARNING XFORM_MPOLE_MATRIX, File = _amoeba_multipoles.f, Line = 822, Column = 8 Initializing a named common block member in a program unit other than a block data is not legal for this architecture. data hind3 /1,2,3,1,1,2,2,3,3,2,3,3,2,1,1/ ^ pathf95-1542 pathf90: WARNING XFORM_MPOLE_MATRIX, File = _amoeba_multipoles.f, Line = 823, Column = 8 Initializing a named common block member in a program unit other than a block data is not legal for this architecture. data hind4 /1,2,3,2,3,1,3,1,2,2,3,3,3,3,2/ ^ pathf95-1542 pathf90: WARNING XFORM_MPOLE_MATRIX, File = _amoeba_multipoles.f, Line = 824, Column = 8 Initializing a named common block member in a program unit other than a block data is not legal for this architecture. pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:23:49 pathf95: 1797 source lines pathf95: 0 Error(s), 9 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P amoeba_induced.f > _amoeba_induced.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_induced.o _amoeba_induced.f pathf90 -cpp -E -P amoeba_vdw.f > _amoeba_vdw.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_vdw.o _amoeba_vdw.f pathf90 -cpp -E -P amoeba_adjust.f > _amoeba_adjust.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_adjust.o _amoeba_adjust.f pathf90 -cpp -E -P amoeba_recip.f > _amoeba_recip.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_recip.o _amoeba_recip.f pathf90 -cpp -E -P amoeba_valence.f > _amoeba_valence.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_valence.o _amoeba_valence.f pathf90 -cpp -E -P amoeba_direct.f > _amoeba_direct.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_direct.o _amoeba_direct.f pathf90 -cpp -E -P amoeba_self.f > _amoeba_self.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_self.o _amoeba_self.f pathf90 -cpp -E -P amoeba_interface.f > _amoeba_interface.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amoeba_interface.o _amoeba_interface.f pathf90 -cpp -E -P sander.f > _sander.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o sander.o _sander.f pathf90 -cpp -E -P trajene.f > _trajene.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o trajene.o _trajene.f pathf90 -cpp -E -P cshf.f > _cshf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o cshf.o _cshf.f pathf90 -cpp -E -P nmrcal.f > _nmrcal.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nmrcal.o _nmrcal.f pathf90 -cpp -E -P pearsn.f > _pearsn.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pearsn.o _pearsn.f pathf90 -cpp -E -P printe.f > _printe.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o printe.o _printe.f pathf90 -cpp -E -P runmin.f > _runmin.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o runmin.o _runmin.f pathf90 -cpp -E -P rdparm.f > _rdparm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rdparm.o _rdparm.f pathf90 -cpp -E -P mdread.f > _mdread.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mdread.o _mdread.f call cnstphread(ix(icpstinf),ix(icpresst),ix(icpptcnt), & ^ pathf95-1279 pathf90: WARNING MDREAD2, File = _mdread.f, Line = 2528, Column = 25 Procedure "CNSTPHREAD" is defined at line 1040 (_mdread.f). The type of this argument does not agree with dummy argument "STATEINF". pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:24:46 pathf95: 3333 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P locmem.f > _locmem.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o locmem.o _locmem.f pathf90 -cpp -E -P bintraj.f > _bintraj.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o bintraj.o _bintraj.f pathf90 -cpp -E -P runmd.f > _runmd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o runmd.o _runmd.f pathf90 -cpp -E -P getcor.f > _getcor.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o getcor.o _getcor.f pathf90 -cpp -E -P degcnt.f > _degcnt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o degcnt.o _degcnt.f pathf90 -cpp -E -P decnvh.f > _decnvh.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o decnvh.o _decnvh.f pathf90 -cpp -E -P spatial_fft.f > _spatial_fft.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o spatial_fft.o _spatial_fft.f pathf90 -cpp -E -P parallel.f > _parallel.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o parallel.o _parallel.f pathf90 -cpp -E -P shake.f > _shake.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o shake.o _shake.f pathf90 -cpp -E -P ene.f > _ene.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ene.o _ene.f pathf90 -cpp -E -P mdwrit.f > _mdwrit.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mdwrit.o _mdwrit.f pathf90 -cpp -E -P minrit.f > _minrit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o minrit.o _minrit.f pathf90 -cpp -E -P set.f > _set.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o set.o _set.f pathf90 -cpp -E -P dynlib.f > _dynlib.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o dynlib.o _dynlib.f pathf90 -cpp -E -P mdfil.f > _mdfil.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mdfil.o _mdfil.f pathf90 -cpp -E -P nmlsrc.f > _nmlsrc.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nmlsrc.o _nmlsrc.f pathf90 -cpp -E -P ew_dipole_recip.f > _ew_dipole_recip.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_dipole_recip.o _ew_dipole_recip.f pathf90 -cpp -E -P spatial_dcmp.f > _spatial_dcmp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o spatial_dcmp.o _spatial_dcmp.f pathf90 -cpp -E -P spatial_recip.f > _spatial_recip.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o spatial_recip.o _spatial_recip.f pathf90 -cpp -E -P ew_force.f > _ew_force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_force.o _ew_force.f pathf90 -cpp -E -P ew_setup.f > _ew_setup.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_setup.o _ew_setup.f pathf90 -cpp -E -P ew_box.f > _ew_box.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_box.o _ew_box.f pathf90 -cpp -E -P ew_fft.f > _ew_fft.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_fft.o _ew_fft.f if ( isign == -1) call cfftf(n1,work,table(1,1)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _ew_fft.f, Line = 1702, Column = 42 Procedure "CFFTF" is defined at line 815 (_ew_fft.f). The type of this argument does not agree with dummy argument "C". if ( isign == 1) call cfftb(n1,work,table(1,1)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _ew_fft.f, Line = 1703, Column = 41 Procedure "CFFTB" is defined at line 731 (_ew_fft.f). The type of this argument does not agree with dummy argument "C". if ( isign == -1) call cfftf(n2,work,table(1,2)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _ew_fft.f, Line = 1717, Column = 42 Procedure "CFFTF" is defined at line 815 (_ew_fft.f). The type of this argument does not agree with dummy argument "C". if ( isign == 1) call cfftb(n2,work,table(1,2)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _ew_fft.f, Line = 1718, Column = 41 Procedure "CFFTB" is defined at line 731 (_ew_fft.f). The type of this argument does not agree with dummy argument "C". if ( isign == -1) call cfftf(n3,work,table(1,3)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _ew_fft.f, Line = 1732, Column = 42 Procedure "CFFTF" is defined at line 815 (_ew_fft.f). The type of this argument does not agree with dummy argument "C". if ( isign == 1) call cfftb(n3,work,table(1,3)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _ew_fft.f, Line = 1733, Column = 41 Procedure "CFFTB" is defined at line 731 (_ew_fft.f). The type of this argument does not agree with dummy argument "C". pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:24:55 pathf95: 1759 source lines pathf95: 0 Error(s), 6 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P short_ene.f > _short_ene.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o short_ene.o _short_ene.f pathf90 -cpp -E -P pcshift.f > _pcshift.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pcshift.o _pcshift.f pathf90 -cpp -E -P align.f > _align.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o align.o _align.f pathf90 -cpp -E -P rfree.f > _rfree.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rfree.o _rfree.f pathf90 -cpp -E -P rgroup.f > _rgroup.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rgroup.o _rgroup.f pathf90 -cpp -E -P random.f > _random.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o random.o _random.f pathf90 -cpp -E -P amopen.f > _amopen.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amopen.o _amopen.f pathf90 -cpp -E -P debug.f > _debug.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o debug.o _debug.f pathf90 -cpp -E -P ew_recip_reg.f > _ew_recip_reg.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_recip_reg.o _ew_recip_reg.f pathf90 -cpp -E -P ew_handle_dips.f > _ew_handle_dips.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_handle_dips.o _ew_handle_dips.f pathf90 -cpp -E -P mexit.f > _mexit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mexit.o _mexit.f pathf90 -cpp -E -P new_time.f > _new_time.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o new_time.o _new_time.f pathf90 -cpp -E -P extra_pts.f > _extra_pts.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o extra_pts.o _extra_pts.f pathf90 -cpp -E -P thermo_int.f > _thermo_int.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o thermo_int.o _thermo_int.f pathf90 -cpp -E -P matinv.f > _matinv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o matinv.o _matinv.f pathf90 -cpp -E -P assert.f > _assert.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o assert.o _assert.f pathf90 -cpp -E -P mmtsb.f > _mmtsb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mmtsb.o _mmtsb.f pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o mmtsb_client.o mmtsb_client.c pathf90 -cpp -E -P erfcfun.f > _erfcfun.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o erfcfun.o _erfcfun.f pathf90 -cpp -E -P veclib.f > _veclib.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o veclib.o _veclib.f pathf90 -cpp -E -P is_init.f > _is_init.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o is_init.o _is_init.f pathf90 -cpp -E -P constantph.f > _constantph.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o constantph.o _constantph.f pathf90 -cpp -E -P prn_dipoles.f > _prn_dipoles.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o prn_dipoles.o _prn_dipoles.f pathf90 -cpp -E -P ips.f > _ips.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ips.o _ips.f pathf90 -cpp -E -P sglds.f > _sglds.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o sglds.o _sglds.f pathf90 -cpp -E -P qm_mm.f > _qm_mm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_mm.o _qm_mm.f pathf90 -cpp -E -P qm_link_atoms.f > _qm_link_atoms.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_link_atoms.o _qm_link_atoms.f pathf90 -cpp -E -P qm_nb_list.f > _qm_nb_list.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_nb_list.o _qm_nb_list.f pathf90 -cpp -E -P qm_extract_coords.f > _qm_extract_coords.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_extract_coords.o _qm_extract_coords.f pathf90 -cpp -E -P qm_ewald.f > _qm_ewald.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_ewald.o _qm_ewald.f pathf90 -cpp -E -P qm_gb.f > _qm_gb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_gb.o _qm_gb.f pathf90 -cpp -E -P qm_zero_charges.f > _qm_zero_charges.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_zero_charges.o _qm_zero_charges.f pathf90 -cpp -E -P qm_print_info.f > _qm_print_info.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_print_info.o _qm_print_info.f pathf90 -cpp -E -P qm_assign_atom_types.f > _qm_assign_atom_types.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_assign_atom_types.o _qm_assign_atom_types.f pathf90 -cpp -E -P qm2_allocate_e_repul.f > _qm2_allocate_e_repul.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_allocate_e_repul.o _qm2_allocate_e_repul.f pathf90 -cpp -E -P qm2_calc_charges.f > _qm2_calc_charges.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_calc_charges.o _qm2_calc_charges.f pathf90 -cpp -E -P qm2_calc_rij_and_eqns.f > _qm2_calc_rij_and_eqns.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_calc_rij_and_eqns.o _qm2_calc_rij_and_eqns.f pathf90 -cpp -E -P qm2_dihed.f > _qm2_dihed.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dihed.o _qm2_dihed.f pathf90 -cpp -E -P qm2_energy.f > _qm2_energy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_energy.o _qm2_energy.f pathf90 -cpp -E -P qm2_fock.f > _qm2_fock.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_fock.o _qm2_fock.f pathf90 -cpp -E -P qm2_get_qm_forces.f > _qm2_get_qm_forces.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_get_qm_forces.o _qm2_get_qm_forces.f pathf90 -cpp -E -P qm2_get_qmmm_forces.f > _qm2_get_qmmm_forces.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_get_qmmm_forces.o _qm2_get_qmmm_forces.f pathf90 -cpp -E -P qm2_h1elec.f > _qm2_h1elec.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_h1elec.o _qm2_h1elec.f pathf90 -cpp -E -P qm2_hcore_qmqm.f > _qm2_hcore_qmqm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_hcore_qmqm.o _qm2_hcore_qmqm.f pathf90 -cpp -E -P qm2_hcore_qmmm.f > _qm2_hcore_qmmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_hcore_qmmm.o _qm2_hcore_qmmm.f pathf90 -cpp -E -P qm2_identify_peptide_links.f > _qm2_identify_peptide_links.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_identify_peptide_links.o _qm2_identify_peptide_links.f pathf90 -cpp -E -P qm2_load_params_and_allocate.f > _qm2_load_params_and_allocate.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_load_params_and_allocate.o _qm2_load_params_and_allocate.f pathf90 -cpp -E -P qm2_repp.f > _qm2_repp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_repp.o _qm2_repp.f pathf90 -cpp -E -P qm2_rotate_qmqm.f > _qm2_rotate_qmqm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_rotate_qmqm.o _qm2_rotate_qmqm.f pathf90 -cpp -E -P qm2_scf.f > _qm2_scf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_scf.o _qm2_scf.f pathf90 -cpp -E -P qm2_setup_orb_exp.f > _qm2_setup_orb_exp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_setup_orb_exp.o _qm2_setup_orb_exp.f pathf90 -cpp -E -P qm2_smallest_number.f > _qm2_smallest_number.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_smallest_number.o _qm2_smallest_number.f pathf90 -cpp -E -P qm2_dftb_module.f > _qm2_dftb_module.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_module.o _qm2_dftb_module.f pathf90 -cpp -E -P qm2_dftb_broyden.f > _qm2_dftb_broyden.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_broyden.o _qm2_dftb_broyden.f pathf90 -cpp -E -P qm2_dftb_dispersion_egr.f > _qm2_dftb_dispersion_egr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_dispersion_egr.o _qm2_dftb_dispersion_egr.f pathf90 -cpp -E -P qm2_dftb_dispersion_params.f > _qm2_dftb_dispersion_params.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_dispersion_params.o _qm2_dftb_dispersion_params.f pathf90 -cpp -E -P qm2_dftb_dispersionread.f > _qm2_dftb_dispersionread.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_dispersionread.o _qm2_dftb_dispersionread.f pathf90 -cpp -E -P qm2_dftb_eglcao.f > _qm2_dftb_eglcao.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_eglcao.o _qm2_dftb_eglcao.f pathf90 -cpp -E -P qm2_dftb_energy.f > _qm2_dftb_energy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_energy.o _qm2_dftb_energy.f pathf90 -cpp -E -P qm2_dftb_ewevge.f > _qm2_dftb_ewevge.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_ewevge.o _qm2_dftb_ewevge.f pathf90 -cpp -E -P qm2_dftb_externalchgrad.f > _qm2_dftb_externalchgrad.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_externalchgrad.o _qm2_dftb_externalchgrad.f pathf90 -cpp -E -P qm2_dftb_externalshift.f > _qm2_dftb_externalshift.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_externalshift.o _qm2_dftb_externalshift.f pathf90 -cpp -E -P qm2_dftb_fermi.f > _qm2_dftb_fermi.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_fermi.o _qm2_dftb_fermi.f pathf90 -cpp -E -P qm2_dftb_forces.f > _qm2_dftb_forces.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_forces.o _qm2_dftb_forces.f pathf90 -cpp -E -P qm2_dftb_gamma.f > _qm2_dftb_gamma.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_gamma.o _qm2_dftb_gamma.f pathf90 -cpp -E -P qm2_dftb_gammamat.f > _qm2_dftb_gammamat.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_gammamat.o _qm2_dftb_gammamat.f pathf90 -cpp -E -P qm2_dftb_get_qmmm_forces.f > _qm2_dftb_get_qmmm_forces.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_get_qmmm_forces.o _qm2_dftb_get_qmmm_forces.f pathf90 -cpp -E -P qm2_dftb_gettab.f > _qm2_dftb_gettab.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_gettab.o _qm2_dftb_gettab.f pathf90 -cpp -E -P qm2_dftb_load_params.f > _qm2_dftb_load_params.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_load_params.o _qm2_dftb_load_params.f pathf90 -cpp -E -P qm2_dftb_long_range.f > _qm2_dftb_long_range.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_long_range.o _qm2_dftb_long_range.f pathf90 -cpp -E -P qm2_dftb_main.f > _qm2_dftb_main.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_main.o _qm2_dftb_main.f pathf90 -cpp -E -P qm2_dftb_my_gradient.f > _qm2_dftb_my_gradient.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_my_gradient.o _qm2_dftb_my_gradient.f pathf90 -cpp -E -P qm2_dftb_my_mulliken.f > _qm2_dftb_my_mulliken.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_my_mulliken.o _qm2_dftb_my_mulliken.f pathf90 -cpp -E -P qm2_dftb_repulsiv.f > _qm2_dftb_repulsiv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_repulsiv.o _qm2_dftb_repulsiv.f pathf90 -cpp -E -P qm2_dftb_self.f > _qm2_dftb_self.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_self.o _qm2_dftb_self.f pathf90 -cpp -E -P qm2_dftb_shift.f > _qm2_dftb_shift.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_shift.o _qm2_dftb_shift.f pathf90 -cpp -E -P qm2_dftb_short_range.f > _qm2_dftb_short_range.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_short_range.o _qm2_dftb_short_range.f pathf90 -cpp -E -P qm2_dftb_skpar.f > _qm2_dftb_skpar.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_skpar.o _qm2_dftb_skpar.f pathf90 -cpp -E -P qm2_dftb_slkode.f > _qm2_dftb_slkode.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_slkode.o _qm2_dftb_slkode.f pathf90 -cpp -E -P qm2_dftb_slktrafo.f > _qm2_dftb_slktrafo.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm2_dftb_slktrafo.o _qm2_dftb_slktrafo.f pathf90 -cpp -E -P qm_div.f > _qm_div.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_div.o _qm_div.f pathf90 -cpp -E -P force.f > _force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o force.o _force.f cd ../lib; make sys.a make[2]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P sys.f > _sys.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sys.o _sys.f pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o wallclock.o wallclock.c ar rv sys.a sys.o wallclock.o ar: creating sys.a a - sys.o a - wallclock.o ranlib sys.a make[2]: Leaving directory `/usr/local/amber9/src/lib' cd ../lib; make nxtsec.o make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `nxtsec.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' cd ../lapack; make make[2]: Entering directory `/usr/local/amber9/src/lapack' Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' pathf90 -cpp -E -P dsyev.f > _dsyev.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsyev.o _dsyev.f pathf90 -cpp -E -P dsygv.f > _dsygv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsygv.o _dsygv.f pathf90 -cpp -E -P dlansy.f > _dlansy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlansy.o _dlansy.f pathf90 -cpp -E -P dsytrd.f > _dsytrd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsytrd.o _dsytrd.f pathf90 -cpp -E -P dorgtr.f > _dorgtr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dorgtr.o _dorgtr.f pathf90 -cpp -E -P dsteqr.f > _dsteqr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsteqr.o _dsteqr.f pathf90 -cpp -E -P dsterf.f > _dsterf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsterf.o _dsterf.f pathf90 -cpp -E -P dlascl.f > _dlascl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlascl.o _dlascl.f pathf90 -cpp -E -P dlamch.f > _dlamch.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlamch.o _dlamch.f pathf90 -cpp -E -P xerbla.f > _xerbla.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o xerbla.o _xerbla.f pathf90 -cpp -E -P ilaenv.f > _ilaenv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ilaenv.o _ilaenv.f pathf90 -cpp -E -P dlassq.f > _dlassq.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlassq.o _dlassq.f pathf90 -cpp -E -P dsytd2.f > _dsytd2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsytd2.o _dsytd2.f pathf90 -cpp -E -P dlatrd.f > _dlatrd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlatrd.o _dlatrd.f pathf90 -cpp -E -P dorgql.f > _dorgql.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dorgql.o _dorgql.f pathf90 -cpp -E -P dorgqr.f > _dorgqr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dorgqr.o _dorgqr.f pathf90 -cpp -E -P dlasrt.f > _dlasrt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlasrt.o _dlasrt.f pathf90 -cpp -E -P dlaset.f > _dlaset.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaset.o _dlaset.f pathf90 -cpp -E -P dlanst.f > _dlanst.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlanst.o _dlanst.f pathf90 -cpp -E -P dlaev2.f > _dlaev2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaev2.o _dlaev2.f pathf90 -cpp -E -P dlasr.f > _dlasr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlasr.o _dlasr.f pathf90 -cpp -E -P dlapy2.f > _dlapy2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlapy2.o _dlapy2.f pathf90 -cpp -E -P dlartg.f > _dlartg.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlartg.o _dlartg.f pathf90 -cpp -E -P dlae2.f > _dlae2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlae2.o _dlae2.f pathf90 -cpp -E -P dorg2r.f > _dorg2r.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dorg2r.o _dorg2r.f pathf90 -cpp -E -P dlarft.f > _dlarft.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlarft.o _dlarft.f pathf90 -cpp -E -P dlarfb.f > _dlarfb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlarfb.o _dlarfb.f pathf90 -cpp -E -P dorg2l.f > _dorg2l.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dorg2l.o _dorg2l.f pathf90 -cpp -E -P dlarfg.f > _dlarfg.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlarfg.o _dlarfg.f pathf90 -cpp -E -P dlarf.f > _dlarf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlarf.o _dlarf.f pathf90 -cpp -E -P dspev.f > _dspev.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dspev.o _dspev.f pathf90 -cpp -E -P dlansp.f > _dlansp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlansp.o _dlansp.f pathf90 -cpp -E -P dsptrd.f > _dsptrd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsptrd.o _dsptrd.f pathf90 -cpp -E -P dopgtr.f > _dopgtr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dopgtr.o _dopgtr.f pathf90 -cpp -E -P dppsv.f > _dppsv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dppsv.o _dppsv.f pathf90 -cpp -E -P dspsv.f > _dspsv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dspsv.o _dspsv.f pathf90 -cpp -E -P dgeev.f > _dgeev.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgeev.o _dgeev.f pathf90 -cpp -E -P dsptrs.f > _dsptrs.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsptrs.o _dsptrs.f pathf90 -cpp -E -P dsptrf.f > _dsptrf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsptrf.o _dsptrf.f pathf90 -cpp -E -P dpptrs.f > _dpptrs.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dpptrs.o _dpptrs.f pathf90 -cpp -E -P dpptrf.f > _dpptrf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dpptrf.o _dpptrf.f pathf90 -cpp -E -P dgebak.f > _dgebak.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgebak.o _dgebak.f pathf90 -cpp -E -P dtrevc.f > _dtrevc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dtrevc.o _dtrevc.f pathf90 -cpp -E -P dlacpy.f > _dlacpy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlacpy.o _dlacpy.f pathf90 -cpp -E -P dhseqr.f > _dhseqr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dhseqr.o _dhseqr.f pathf90 -cpp -E -P dorghr.f > _dorghr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dorghr.o _dorghr.f pathf90 -cpp -E -P dgehrd.f > _dgehrd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgehrd.o _dgehrd.f pathf90 -cpp -E -P dgebal.f > _dgebal.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgebal.o _dgebal.f pathf90 -cpp -E -P dlange.f > _dlange.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlange.o _dlange.f pathf90 -cpp -E -P dlabad.f > _dlabad.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlabad.o _dlabad.f pathf90 -cpp -E -P dlahqr.f > _dlahqr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlahqr.o _dlahqr.f pathf90 -cpp -E -P dlarfx.f > _dlarfx.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlarfx.o _dlarfx.f pathf90 -cpp -E -P dlanhs.f > _dlanhs.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlanhs.o _dlanhs.f pathf90 -cpp -E -P dlaln2.f > _dlaln2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaln2.o _dlaln2.f pathf90 -cpp -E -P dgehd2.f > _dgehd2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgehd2.o _dgehd2.f pathf90 -cpp -E -P dlahrd.f > _dlahrd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlahrd.o _dlahrd.f pathf90 -cpp -E -P dlanv2.f > _dlanv2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlanv2.o _dlanv2.f pathf90 -cpp -E -P dladiv.f > _dladiv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dladiv.o _dladiv.f pathf90 -cpp -E -P dgerq2.f > _dgerq2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgerq2.o _dgerq2.f pathf90 -cpp -E -P dorm2r.f > _dorm2r.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dorm2r.o _dorm2r.f pathf90 -cpp -E -P dlarnv.f > _dlarnv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlarnv.o _dlarnv.f pathf90 -cpp -E -P dgeqr2.f > _dgeqr2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgeqr2.o _dgeqr2.f pathf90 -cpp -E -P dlaruv.f > _dlaruv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaruv.o _dlaruv.f pathf90 -cpp -E -P dspevd.f > _dspevd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dspevd.o _dspevd.f pathf90 -cpp -E -P dstedc.f > _dstedc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dstedc.o _dstedc.f pathf90 -cpp -E -P dopmtr.f > _dopmtr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dopmtr.o _dopmtr.f pathf90 -cpp -E -P dlaed0.f > _dlaed0.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaed0.o _dlaed0.f pathf90 -cpp -E -P dlaed1.f > _dlaed1.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaed1.o _dlaed1.f pathf90 -cpp -E -P dlaed7.f > _dlaed7.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaed7.o _dlaed7.f pathf90 -cpp -E -P dlaeda.f > _dlaeda.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaeda.o _dlaeda.f pathf90 -cpp -E -P dlaed8.f > _dlaed8.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaed8.o _dlaed8.f pathf90 -cpp -E -P dlaed9.f > _dlaed9.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaed9.o _dlaed9.f pathf90 -cpp -E -P dlamrg.f > _dlamrg.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlamrg.o _dlamrg.f pathf90 -cpp -E -P dlaed2.f > _dlaed2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaed2.o _dlaed2.f pathf90 -cpp -E -P dlaed3.f > _dlaed3.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaed3.o _dlaed3.f pathf90 -cpp -E -P dpotrf.f > _dpotrf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dpotrf.o _dpotrf.f pathf90 -cpp -E -P dsygst.f > _dsygst.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsygst.o _dsygst.f pathf90 -cpp -E -P dpotf2.f > _dpotf2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dpotf2.o _dpotf2.f pathf90 -cpp -E -P dsygs2.f > _dsygs2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsygs2.o _dsygs2.f pathf90 -cpp -E -P dlaebz.f > _dlaebz.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaebz.o _dlaebz.f *DIR$ NOVECTOR ^ pathf95-801 pathf90: WARNING DLAEBZ, File = _dlaebz.f, Line = 256, Column = 7 Unsupported compiler directive. CDIR$ NEXTSCALAR ^ pathf95-801 pathf90: WARNING DLAEBZ, File = _dlaebz.f, Line = 416, Column = 16 Unsupported compiler directive. CDIR$ NEXT SCALAR ^ pathf95-801 pathf90: WARNING DLAEBZ, File = _dlaebz.f, Line = 418, Column = 16 Unsupported compiler directive. pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:25:46 pathf95: 553 source lines pathf95: 0 Error(s), 3 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P dlagtf.f > _dlagtf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlagtf.o _dlagtf.f pathf90 -cpp -E -P dlagts.f > _dlagts.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlagts.o _dlagts.f pathf90 -cpp -E -P dormqr.f > _dormqr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dormqr.o _dormqr.f pathf90 -cpp -E -P dormql.f > _dormql.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dormql.o _dormql.f pathf90 -cpp -E -P dorm2l.f > _dorm2l.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dorm2l.o _dorm2l.f pathf90 -cpp -E -P dlaed4.f > _dlaed4.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaed4.o _dlaed4.f pathf90 -cpp -E -P dlaed5.f > _dlaed5.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaed5.o _dlaed5.f pathf90 -cpp -E -P dlaed6.f > _dlaed6.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaed6.o _dlaed6.f pathf90 -cpp -E -P ieeeck.f > _ieeeck.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ieeeck.o _ieeeck.f pathf90 -cpp -E -P dsyevx.f > _dsyevx.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsyevx.o _dsyevx.f pathf90 -cpp -E -P dsyevd.f > _dsyevd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsyevd.o _dsyevd.f pathf90 -cpp -E -P dstebz.f > _dstebz.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dstebz.o _dstebz.f *DIR$ NOVECTOR ^ pathf95-801 pathf90: WARNING DSTEBZ, File = _dstebz.f, Line = 305, Column = 7 Unsupported compiler directive. pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:25:48 pathf95: 654 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P dstein.f > _dstein.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dstein.o _dstein.f pathf90 -cpp -E -P dormtr.f > _dormtr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dormtr.o _dormtr.f pathf90 -cpp -E -P zheev.f > _zheev.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zheev.o _zheev.f pathf90 -cpp -E -P lsame.f > _lsame.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o lsame.o _lsame.f pathf90 -cpp -E -P zlanhe.f > _zlanhe.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlanhe.o _zlanhe.f pathf90 -cpp -E -P zlascl.f > _zlascl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlascl.o _zlascl.f pathf90 -cpp -E -P zhetrd.f > _zhetrd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zhetrd.o _zhetrd.f pathf90 -cpp -E -P zungtr.f > _zungtr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zungtr.o _zungtr.f pathf90 -cpp -E -P zsteqr.f > _zsteqr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zsteqr.o _zsteqr.f pathf90 -cpp -E -P zlassq.f > _zlassq.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlassq.o _zlassq.f pathf90 -cpp -E -P zlatrd.f > _zlatrd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlatrd.o _zlatrd.f pathf90 -cpp -E -P zhetd2.f > _zhetd2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zhetd2.o _zhetd2.f pathf90 -cpp -E -P zungql.f > _zungql.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zungql.o _zungql.f pathf90 -cpp -E -P zungqr.f > _zungqr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zungqr.o _zungqr.f pathf90 -cpp -E -P zlasr.f > _zlasr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlasr.o _zlasr.f pathf90 -cpp -E -P zlaset.f > _zlaset.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlaset.o _zlaset.f pathf90 -cpp -E -P zlacgv.f > _zlacgv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlacgv.o _zlacgv.f pathf90 -cpp -E -P zlarfg.f > _zlarfg.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlarfg.o _zlarfg.f pathf90 -cpp -E -P zung2l.f > _zung2l.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zung2l.o _zung2l.f pathf90 -cpp -E -P zlarft.f > _zlarft.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlarft.o _zlarft.f pathf90 -cpp -E -P zlarfb.f > _zlarfb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlarfb.o _zlarfb.f pathf90 -cpp -E -P zung2r.f > _zung2r.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zung2r.o _zung2r.f pathf90 -cpp -E -P dlapy3.f > _dlapy3.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlapy3.o _dlapy3.f pathf90 -cpp -E -P zladiv.f > _zladiv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zladiv.o _zladiv.f pathf90 -cpp -E -P zlarf.f > _zlarf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zlarf.o _zlarf.f ar rv lapack.a dsyev.o dsygv.o dlansy.o dsytrd.o dorgtr.o dsteqr.o dsterf.o dlascl.o dlamch.o xerbla.o ilaenv.o dlassq.o dsytd2.o dlatrd.o dorgql.o dorgqr.o dlasrt.o dlaset.o dlanst.o dlaev2.o dlasr.o dlapy2.o dlartg.o dlae2.o dorg2r.o dlarft.o dlarfb.o dorg2l.o dlarfg.o dlarf.o dspev.o dlansp.o dsptrd.o dopgtr.o dppsv.o dspsv.o dgeev.o dsptrs.o dsptrf.o dpptrs.o dpptrf.o dgebak.o dtrevc.o dlacpy.o dhseqr.o dorghr.o dgehrd.o dgebal.o dlange.o dlabad.o dlahqr.o dlarfx.o dlanhs.o dlaln2.o dgehd2.o dlahrd.o dlanv2.o dladiv.o dgerq2.o dorm2r.o dlarnv.o dgeqr2.o dlaruv.o dspevd.o dstedc.o dopmtr.o dlaed0.o dlaed1.o dlaed7.o dlaeda.o dlaed8.o dlaed9.o dlamrg.o dlaed2.o dlaed3.o dpotrf.o dsygst.o dpotf2.o dsygs2.o dlaebz.o dlagtf.o dlagts.o dormqr.o dormql.o dorm2l.o dlaed4.o dlaed5.o dlaed6.o ieeeck.o dsyevx.o dsyevd.o dstebz.o dstein.o dormtr.o zheev.o lsame.o zlanhe.o zlascl.o zhetrd.o zungtr.o zsteqr.o zlassq.o zlatrd.o zhetd2.o zungql.o zungqr.o zlasr.o zlaset.o zlacgv.o zlarfg.o zung2l.o zlarft.o zlarfb.o zung2r.o dlapy3.o zladiv.o zlarf.o ar: creating lapack.a a - dsyev.o a - dsygv.o a - dlansy.o a - dsytrd.o a - dorgtr.o a - dsteqr.o a - dsterf.o a - dlascl.o a - dlamch.o a - xerbla.o a - ilaenv.o a - dlassq.o a - dsytd2.o a - dlatrd.o a - dorgql.o a - dorgqr.o a - dlasrt.o a - dlaset.o a - dlanst.o a - dlaev2.o a - dlasr.o a - dlapy2.o a - dlartg.o a - dlae2.o a - dorg2r.o a - dlarft.o a - dlarfb.o a - dorg2l.o a - dlarfg.o a - dlarf.o a - dspev.o a - dlansp.o a - dsptrd.o a - dopgtr.o a - dppsv.o a - dspsv.o a - dgeev.o a - dsptrs.o a - dsptrf.o a - dpptrs.o a - dpptrf.o a - dgebak.o a - dtrevc.o a - dlacpy.o a - dhseqr.o a - dorghr.o a - dgehrd.o a - dgebal.o a - dlange.o a - dlabad.o a - dlahqr.o a - dlarfx.o a - dlanhs.o a - dlaln2.o a - dgehd2.o a - dlahrd.o a - dlanv2.o a - dladiv.o a - dgerq2.o a - dorm2r.o a - dlarnv.o a - dgeqr2.o a - dlaruv.o a - dspevd.o a - dstedc.o a - dopmtr.o a - dlaed0.o a - dlaed1.o a - dlaed7.o a - dlaeda.o a - dlaed8.o a - dlaed9.o a - dlamrg.o a - dlaed2.o a - dlaed3.o a - dpotrf.o a - dsygst.o a - dpotf2.o a - dsygs2.o a - dlaebz.o a - dlagtf.o a - dlagts.o a - dormqr.o a - dormql.o a - dorm2l.o a - dlaed4.o a - dlaed5.o a - dlaed6.o a - ieeeck.o a - dsyevx.o a - dsyevd.o a - dstebz.o a - dstein.o a - dormtr.o a - zheev.o a - lsame.o a - zlanhe.o a - zlascl.o a - zhetrd.o a - zungtr.o a - zsteqr.o a - zlassq.o a - zlatrd.o a - zhetd2.o a - zungql.o a - zungqr.o a - zlasr.o a - zlaset.o a - zlacgv.o a - zlarfg.o a - zung2l.o a - zlarft.o a - zlarfb.o a - zung2r.o a - dlapy3.o a - zladiv.o a - zlarf.o ranlib lapack.a make[2]: Leaving directory `/usr/local/amber9/src/lapack' cd ../blas; make make[2]: Entering directory `/usr/local/amber9/src/blas' Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' pathf90 -cpp -E -P dasum.f > _dasum.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dasum.o _dasum.f pathf90 -cpp -E -P daxpy.f > _daxpy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o daxpy.o _daxpy.f pathf90 -cpp -E -P dcabs1.f > _dcabs1.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dcabs1.o _dcabs1.f pathf90 -cpp -E -P dcopy.f > _dcopy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dcopy.o _dcopy.f pathf90 -cpp -E -P ddot.f > _ddot.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ddot.o _ddot.f pathf90 -cpp -E -P dgbmv.f > _dgbmv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgbmv.o _dgbmv.f pathf90 -cpp -E -P dgemm.f > _dgemm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgemm.o _dgemm.f pathf90 -cpp -E -P dgemv.f > _dgemv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgemv.o _dgemv.f pathf90 -cpp -E -P dger.f > _dger.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dger.o _dger.f pathf90 -cpp -E -P dnrm2.f > _dnrm2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dnrm2.o _dnrm2.f pathf90 -cpp -E -P drot.f > _drot.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o drot.o _drot.f pathf90 -cpp -E -P drotg.f > _drotg.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o drotg.o _drotg.f pathf90 -cpp -E -P dsbmv.f > _dsbmv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsbmv.o _dsbmv.f pathf90 -cpp -E -P dscal.f > _dscal.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dscal.o _dscal.f pathf90 -cpp -E -P dspmv.f > _dspmv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dspmv.o _dspmv.f pathf90 -cpp -E -P dspr.f > _dspr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dspr.o _dspr.f pathf90 -cpp -E -P dspr2.f > _dspr2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dspr2.o _dspr2.f pathf90 -cpp -E -P dswap.f > _dswap.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dswap.o _dswap.f pathf90 -cpp -E -P dsymm.f > _dsymm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsymm.o _dsymm.f pathf90 -cpp -E -P dsymv.f > _dsymv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsymv.o _dsymv.f pathf90 -cpp -E -P dsyr.f > _dsyr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsyr.o _dsyr.f pathf90 -cpp -E -P dsyr2.f > _dsyr2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsyr2.o _dsyr2.f pathf90 -cpp -E -P dsyr2k.f > _dsyr2k.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsyr2k.o _dsyr2k.f pathf90 -cpp -E -P dsyrk.f > _dsyrk.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsyrk.o _dsyrk.f pathf90 -cpp -E -P dtbmv.f > _dtbmv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dtbmv.o _dtbmv.f pathf90 -cpp -E -P dtbsv.f > _dtbsv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dtbsv.o _dtbsv.f pathf90 -cpp -E -P dtpmv.f > _dtpmv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dtpmv.o _dtpmv.f pathf90 -cpp -E -P dtpsv.f > _dtpsv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dtpsv.o _dtpsv.f pathf90 -cpp -E -P dtrmm.f > _dtrmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dtrmm.o _dtrmm.f pathf90 -cpp -E -P dtrmv.f > _dtrmv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dtrmv.o _dtrmv.f pathf90 -cpp -E -P dtrsm.f > _dtrsm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dtrsm.o _dtrsm.f pathf90 -cpp -E -P dtrsv.f > _dtrsv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dtrsv.o _dtrsv.f pathf90 -cpp -E -P dummy.f > _dummy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dummy.o _dummy.f pathf90 -cpp -E -P dzasum.f > _dzasum.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dzasum.o _dzasum.f pathf90 -cpp -E -P dznrm2.f > _dznrm2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dznrm2.o _dznrm2.f pathf90 -cpp -E -P idamax.f > _idamax.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o idamax.o _idamax.f pathf90 -cpp -E -P isamax.f > _isamax.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o isamax.o _isamax.f pathf90 -cpp -E -P lsame.f > _lsame.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o lsame.o _lsame.f pathf90 -cpp -E -P scopy.f > _scopy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o scopy.o _scopy.f pathf90 -cpp -E -P sswap.f > _sswap.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sswap.o _sswap.f pathf90 -cpp -E -P sscal.f > _sscal.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sscal.o _sscal.f pathf90 -cpp -E -P sasum.f > _sasum.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sasum.o _sasum.f pathf90 -cpp -E -P snrm2.f > _snrm2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o snrm2.o _snrm2.f pathf90 -cpp -E -P sdot.f > _sdot.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sdot.o _sdot.f pathf90 -cpp -E -P ssyr2k.f > _ssyr2k.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssyr2k.o _ssyr2k.f pathf90 -cpp -E -P saxpy.f > _saxpy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o saxpy.o _saxpy.f pathf90 -cpp -E -P sgemv.f > _sgemv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sgemv.o _sgemv.f pathf90 -cpp -E -P ssyr2.f > _ssyr2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssyr2.o _ssyr2.f pathf90 -cpp -E -P ssymv.f > _ssymv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssymv.o _ssymv.f pathf90 -cpp -E -P sgemm.f > _sgemm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sgemm.o _sgemm.f pathf90 -cpp -E -P strmm.f > _strmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o strmm.o _strmm.f pathf90 -cpp -E -P strmv.f > _strmv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o strmv.o _strmv.f pathf90 -cpp -E -P sger.f > _sger.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sger.o _sger.f pathf90 -cpp -E -P zher2k.f > _zher2k.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zher2k.o _zher2k.f pathf90 -cpp -E -P zswap.f > _zswap.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zswap.o _zswap.f pathf90 -cpp -E -P zgemv.f > _zgemv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zgemv.o _zgemv.f pathf90 -cpp -E -P zhemv.f > _zhemv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zhemv.o _zhemv.f pathf90 -cpp -E -P zscal.f > _zscal.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zscal.o _zscal.f pathf90 -cpp -E -P zdotc.f > _zdotc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zdotc.o _zdotc.f pathf90 -cpp -E -P zaxpy.f > _zaxpy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zaxpy.o _zaxpy.f pathf90 -cpp -E -P zher2.f > _zher2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zher2.o _zher2.f pathf90 -cpp -E -P zdscal.f > _zdscal.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zdscal.o _zdscal.f pathf90 -cpp -E -P ztrmv.f > _ztrmv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ztrmv.o _ztrmv.f pathf90 -cpp -E -P zcopy.f > _zcopy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zcopy.o _zcopy.f pathf90 -cpp -E -P ztrmm.f > _ztrmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ztrmm.o _ztrmm.f pathf90 -cpp -E -P zgemm.f > _zgemm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zgemm.o _zgemm.f pathf90 -cpp -E -P zgerc.f > _zgerc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o zgerc.o _zgerc.f ar rv blas.a dasum.o daxpy.o dcabs1.o dcopy.o ddot.o dgbmv.o dgemm.o dgemv.o dger.o dnrm2.o drot.o drotg.o dsbmv.o dscal.o dspmv.o dspr.o dspr2.o dswap.o dsymm.o dsymv.o dsyr.o dsyr2.o dsyr2k.o dsyrk.o dtbmv.o dtbsv.o dtpmv.o dtpsv.o dtrmm.o dtrmv.o dtrsm.o dtrsv.o dummy.o dzasum.o dznrm2.o idamax.o isamax.o lsame.o scopy.o sswap.o sscal.o sasum.o snrm2.o sdot.o ssyr2k.o saxpy.o sgemv.o ssyr2.o ssymv.o sgemm.o strmm.o strmv.o sger.o zher2k.o zswap.o zgemv.o zhemv.o zscal.o zdotc.o zaxpy.o zher2.o zdscal.o ztrmv.o zcopy.o ztrmm.o zgemm.o zgerc.o ar: creating blas.a a - dasum.o a - daxpy.o a - dcabs1.o a - dcopy.o a - ddot.o a - dgbmv.o a - dgemm.o a - dgemv.o a - dger.o a - dnrm2.o a - drot.o a - drotg.o a - dsbmv.o a - dscal.o a - dspmv.o a - dspr.o a - dspr2.o a - dswap.o a - dsymm.o a - dsymv.o a - dsyr.o a - dsyr2.o a - dsyr2k.o a - dsyrk.o a - dtbmv.o a - dtbsv.o a - dtpmv.o a - dtpsv.o a - dtrmm.o a - dtrmv.o a - dtrsm.o a - dtrsv.o a - dummy.o a - dzasum.o a - dznrm2.o a - idamax.o a - isamax.o a - lsame.o a - scopy.o a - sswap.o a - sscal.o a - sasum.o a - snrm2.o a - sdot.o a - ssyr2k.o a - saxpy.o a - sgemv.o a - ssyr2.o a - ssymv.o a - sgemm.o a - strmm.o a - strmv.o a - sger.o a - zher2k.o a - zswap.o a - zgemv.o a - zhemv.o a - zscal.o a - zdotc.o a - zaxpy.o a - zher2.o a - zdscal.o a - ztrmv.o a - zcopy.o a - ztrmm.o a - zgemm.o a - zgerc.o ranlib blas.a make[2]: Leaving directory `/usr/local/amber9/src/blas' cd ../lmod; make make[2]: Entering directory `/usr/local/amber9/src/lmod' cd xmin; make make[3]: Entering directory `/usr/local/amber9/src/lmod/xmin' Makefile:6: warning: overriding commands for target `.f.o' ../../config.h:82: warning: ignoring old commands for target `.f.o' pathf90 -cpp -E -P xmin.f > _xmin.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o xmin.o _xmin.f make[3]: Leaving directory `/usr/local/amber9/src/lmod/xmin' cd lmod; make make[3]: Entering directory `/usr/local/amber9/src/lmod/lmod' Makefile:6: warning: overriding commands for target `.f.o' ../../config.h:82: warning: ignoring old commands for target `.f.o' pathf90 -cpp -E -P lmod.f > _lmod.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o lmod.o _lmod.f make[3]: Leaving directory `/usr/local/amber9/src/lmod/lmod' ar rv lmod.a xmin/*.o lmod/*.o ar: creating lmod.a a - xmin/xmin.o a - lmod/lmod.o ranlib lmod.a make[2]: Leaving directory `/usr/local/amber9/src/lmod' cd ../lmod; cp lmodprmtop ../../exe; chmod 0755 ../../exe/lmodprmtop cd ../dcqtp; make libdivcon.a make[2]: Entering directory `/usr/local/amber9/src/dcqtp' cd mod; make libdivcon.a make[3]: Entering directory `/usr/local/amber9/src/dcqtp/mod' pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/param/param_module.F90 > ../obj/param_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/param_module.o ../obj/param_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/math/math_module.F90 > ../obj/math_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/math_module.o ../obj/math_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mm/mm_module.F90 > ../obj/mm_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mm_module.o ../obj/mm_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/error_module.F90 > ../obj/error_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/error_module.o ../obj/error_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_module.F90 > ../obj/pme_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_module.o ../obj/pme_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/nmr_module.F90 > ../obj/nmr_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/nmr_module.o ../obj/nmr_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/dc_module.F90 > ../obj/dc_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dc_module.o ../obj/dc_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/freq/freq_module.F90 > ../obj/freq_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/freq_module.o ../obj/freq_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ham/mndod_module.F90 > ../obj/mndod_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mndod_module.o ../obj/mndod_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ham/pddgpm3_module.F90 > ../obj/pddgpm3_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pddgpm3_module.o ../obj/pddgpm3_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/int_module.F90 > ../obj/int_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/int_module.o ../obj/int_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/mc_module.F90 > ../obj/mc_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mc_module.o ../obj/mc_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/tools_module.F90 > ../obj/tools_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/tools_module.o ../obj/tools_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ts/ts_module.F90 > ../obj/ts_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/ts_module.o ../obj/ts_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/scf/scf_module.F90 > ../obj/scf_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/scf_module.o ../obj/scf_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/mndonmr_module.F90 > ../obj/mndonmr_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mndonmr_module.o ../obj/mndonmr_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/min_module.F90 > ../obj/min_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/min_module.o ../obj/min_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/element_module.F90 > ../obj/element_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/element_module.o ../obj/element_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/global_module.F90 > ../obj/global_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/global_module.o ../obj/global_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/chg/chgRdKeys.F90 > ../obj/chgRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/chgRdKeys.o ../obj/chgRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/ioRdKeys.F90 > ../obj/ioRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/ioRdKeys.o ../obj/ioRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/ioRdTail.F90 > ../obj/ioRdTail.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/ioRdTail.o ../obj/ioRdTail.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/dcRdKeys.F90 > ../obj/dcRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dcRdKeys.o ../obj/dcRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/dcRdTail.F90 > ../obj/dcRdTail.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dcRdTail.o ../obj/dcRdTail.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/mcRdKeys.F90 > ../obj/mcRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mcRdKeys.o ../obj/mcRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/minRdKeys.F90 > ../obj/minRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/minRdKeys.o ../obj/minRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/minRdTail.F90 > ../obj/minRdTail.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/minRdTail.o ../obj/minRdTail.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mm/mmRdKeys.F90 > ../obj/mmRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mmRdKeys.o ../obj/mmRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mm/mmRdTail.F90 > ../obj/mmRdTail.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mmRdTail.o ../obj/mmRdTail.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/nmrRdKeys.F90 > ../obj/nmrRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/nmrRdKeys.o ../obj/nmrRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/nmrRdTail.F90 > ../obj/nmrRdTail.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/nmrRdTail.o ../obj/nmrRdTail.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/param/paramRdKeys.F90 > ../obj/paramRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/paramRdKeys.o ../obj/paramRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpmodule.F90 > ../obj/dpmodule.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpmodule.o ../obj/dpmodule.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/pbRdKeys.F90 > ../obj/pbRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pbRdKeys.o ../obj/pbRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pmeRdKeys.F90 > ../obj/pmeRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pmeRdKeys.o ../obj/pmeRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/scf/scfRdKeys.F90 > ../obj/scfRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/scfRdKeys.o ../obj/scfRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ts/tsRdKeys.F90 > ../obj/tsRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/tsRdKeys.o ../obj/tsRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/atgrid.F90 > ../obj/atgrid.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/atgrid.o ../obj/atgrid.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/chkres.F90 > ../obj/chkres.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/chkres.o ../obj/chkres.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/clustsub.F90 > ../obj/clustsub.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/clustsub.o ../obj/clustsub.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/cmbcore.F90 > ../obj/cmbcore.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/cmbcore.o ../obj/cmbcore.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/cmbsub.F90 > ../obj/cmbsub.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/cmbsub.o ../obj/cmbsub.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/doferm.F90 > ../obj/doferm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/doferm.o ../obj/doferm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/esqr.F90 > ../obj/esqr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/esqr.o ../obj/esqr.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/esqrfdm.F90 > ../obj/esqrfdm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/esqrfdm.o ../obj/esqrfdm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/save_module.F90 > ../obj/save_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/save_module.o ../obj/save_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/frmchk.F90 > ../obj/frmchk.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/frmchk.o ../obj/frmchk.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/fshift.F90 > ../obj/fshift.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/fshift.o ../obj/fshift.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/gensub.F90 > ../obj/gensub.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/gensub.o ../obj/gensub.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/gridafnc.F90 > ../obj/gridafnc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/gridafnc.o ../obj/gridafnc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/gridrfnc.F90 > ../obj/gridrfnc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/gridrfnc.o ../obj/gridrfnc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/mixgrid.F90 > ../obj/mixgrid.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mixgrid.o ../obj/mixgrid.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/mkgrid.F90 > ../obj/mkgrid.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mkgrid.o ../obj/mkgrid.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/pgridafnc.F90 > ../obj/pgridafnc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pgridafnc.o ../obj/pgridafnc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/pgridrfnc.F90 > ../obj/pgridrfnc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pgridrfnc.o ../obj/pgridrfnc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/resgrid.F90 > ../obj/resgrid.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/resgrid.o ../obj/resgrid.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/setncell.F90 > ../obj/setncell.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/setncell.o ../obj/setncell.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/dc/sproc.F90 > ../obj/sproc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/sproc.o ../obj/sproc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/freq/freq.F90 > ../obj/freq.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/freq.o ../obj/freq.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/freq/hsep.F90 > ../obj/hsep.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/hsep.o ../obj/hsep.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/freq/freqRdKeys.F90 > ../obj/freqRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/freqRdKeys.o ../obj/freqRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/freq/freqRdTail.F90 > ../obj/freqRdTail.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/freqRdTail.o ../obj/freqRdTail.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ham/hamRdKeys.F90 > ../obj/hamRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/hamRdKeys.o ../obj/hamRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ham/mndo_module.F90 > ../obj/mndo_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mndo_module.o ../obj/mndo_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ham/am1_module.F90 > ../obj/am1_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/am1_module.o ../obj/am1_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ham/pm3_module.F90 > ../obj/pm3_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pm3_module.o ../obj/pm3_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/aijm.F90 > ../obj/aijm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/aijm.o ../obj/aijm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/attrecurse.F90 > ../obj/attrecurse.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/attrecurse.o ../obj/attrecurse.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/ddpo.F90 > ../obj/ddpo.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/ddpo.o ../obj/ddpo.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/diat.F90 > ../obj/diat.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/diat.o ../obj/diat.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/ecd.F90 > ../obj/ecd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/ecd.o ../obj/ecd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/electricfield.F90 > ../obj/electricfield.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/electricfield.o ../obj/electricfield.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/erecursive.F90 > ../obj/erecursive.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/erecursive.o ../obj/erecursive.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/FmT.F90 > ../obj/FmT.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/FmT.o ../obj/FmT.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/inighd.F90 > ../obj/inighd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/inighd.o ../obj/inighd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intdd1.F90 > ../obj/intdd1.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intdd1.o ../obj/intdd1.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intdd2.F90 > ../obj/intdd2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intdd2.o ../obj/intdd2.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intdd3.F90 > ../obj/intdd3.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intdd3.o ../obj/intdd3.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intdd4.F90 > ../obj/intdd4.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intdd4.o ../obj/intdd4.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intdd5.F90 > ../obj/intdd5.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intdd5.o ../obj/intdd5.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intdd6.F90 > ../obj/intdd6.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intdd6.o ../obj/intdd6.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intdd.F90 > ../obj/intdd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intdd.o ../obj/intdd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intdp.F90 > ../obj/intdp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intdp.o ../obj/intdp.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intds.F90 > ../obj/intds.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intds.o ../obj/intds.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intpd.F90 > ../obj/intpd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intpd.o ../obj/intpd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intsd.F90 > ../obj/intsd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intsd.o ../obj/intsd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/localdd.F90 > ../obj/localdd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/localdd.o ../obj/localdd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/localdp.F90 > ../obj/localdp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/localdp.o ../obj/localdp.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/localds.F90 > ../obj/localds.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/localds.o ../obj/localds.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/localpd.F90 > ../obj/localpd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/localpd.o ../obj/localpd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/localsd.F90 > ../obj/localsd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/localsd.o ../obj/localsd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/overlap.F90 > ../obj/overlap.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/overlap.o ../obj/overlap.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/overlp.F90 > ../obj/overlp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/overlp.o ../obj/overlp.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/repuld.F90 > ../obj/repuld.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/repuld.o ../obj/repuld.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/repul.F90 > ../obj/repul.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/repul.o ../obj/repul.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/sabt.F90 > ../obj/sabt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/sabt.o ../obj/sabt.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/setdorb.F90 > ../obj/setdorb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/setdorb.o ../obj/setdorb.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/slow.F90 > ../obj/slow.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/slow.o ../obj/slow.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/slowi.F90 > ../obj/slowi.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/slowi.o ../obj/slowi.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/intRdKeys.F90 > ../obj/intRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intRdKeys.o ../obj/intRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/getversion.F90 > ../obj/getversion.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/getversion.o ../obj/getversion.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/header.F90 > ../obj/header.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/header.o ../obj/header.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/printen.F90 > ../obj/printen.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/printen.o ../obj/printen.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/printpar.F90 > ../obj/printpar.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/printpar.o ../obj/printpar.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/printsub.F90 > ../obj/printsub.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/printsub.o ../obj/printsub.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdcoord.F90 > ../obj/rdcoord.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdcoord.o ../obj/rdcoord.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdbelly.F90 > ../obj/rdbelly.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdbelly.o ../obj/rdbelly.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdbox.F90 > ../obj/rdbox.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdbox.o ../obj/rdbox.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdchemix.F90 > ../obj/rdchemix.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdchemix.o ../obj/rdchemix.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdcluster.F90 > ../obj/rdcluster.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdcluster.o ../obj/rdcluster.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdcomb.F90 > ../obj/rdcomb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdcomb.o ../obj/rdcomb.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rddmx.F90 > ../obj/rddmx.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rddmx.o ../obj/rddmx.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rddos.F90 > ../obj/rddos.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rddos.o ../obj/rddos.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdgrid.F90 > ../obj/rdgrid.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdgrid.o ../obj/rdgrid.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdgroup.F90 > ../obj/rdgroup.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdgroup.o ../obj/rdgroup.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdguess.F90 > ../obj/rdguess.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdguess.o ../obj/rdguess.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdhess.F90 > ../obj/rdhess.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdhess.o ../obj/rdhess.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdint.F90 > ../obj/rdint.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdint.o ../obj/rdint.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdkeys.F90 > ../obj/rdkeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdkeys.o ../obj/rdkeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdlist.F90 > ../obj/rdlist.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdlist.o ../obj/rdlist.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdneighb.F90 > ../obj/rdneighb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdneighb.o ../obj/rdneighb.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdnext.F90 > ../obj/rdnext.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdnext.o ../obj/rdnext.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdnmr.F90 > ../obj/rdnmr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdnmr.o ../obj/rdnmr.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdnum.F90 > ../obj/rdnum.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdnum.o ../obj/rdnum.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdpdb.F90 > ../obj/rdpdb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdpdb.o ../obj/rdpdb.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdprtvec.F90 > ../obj/rdprtvec.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdprtvec.o ../obj/rdprtvec.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdrestraints.F90 > ../obj/rdrestraints.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdrestraints.o ../obj/rdrestraints.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdrst.F90 > ../obj/rdrst.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdrst.o ../obj/rdrst.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdsub.F90 > ../obj/rdsub.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdsub.o ../obj/rdsub.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdtail.F90 > ../obj/rdtail.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdtail.o ../obj/rdtail.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mm/ljglobals.F90 > ../obj/ljglobals.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/ljglobals.o ../obj/ljglobals.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdvdw.F90 > ../obj/rdvdw.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdvdw.o ../obj/rdvdw.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdword.F90 > ../obj/rdword.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdword.o ../obj/rdword.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/rdxyz.F90 > ../obj/rdxyz.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rdxyz.o ../obj/rdxyz.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtchg.F90 > ../obj/wrtchg.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtchg.o ../obj/wrtchg.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtcoor.F90 > ../obj/wrtcoor.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtcoor.o ../obj/wrtcoor.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtdefaultkeys.F90 > ../obj/wrtdefaultkeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtdefaultkeys.o ../obj/wrtdefaultkeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtdiv.F90 > ../obj/wrtdiv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtdiv.o ../obj/wrtdiv.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtdmx.F90 > ../obj/wrtdmx.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtdmx.o ../obj/wrtdmx.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtgrd.F90 > ../obj/wrtgrd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtgrd.o ../obj/wrtgrd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrthss.F90 > ../obj/wrthss.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrthss.o ../obj/wrthss.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtint.F90 > ../obj/wrtint.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtint.o ../obj/wrtint.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtpdb.F90 > ../obj/wrtpdb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtpdb.o ../obj/wrtpdb.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtqma.F90 > ../obj/wrtqma.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtqma.o ../obj/wrtqma.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtrep.F90 > ../obj/wrtrep.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtrep.o ../obj/wrtrep.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtrst.F90 > ../obj/wrtrst.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtrst.o ../obj/wrtrst.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrttim.F90 > ../obj/wrttim.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrttim.o ../obj/wrttim.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtvec.F90 > ../obj/wrtvec.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtvec.o ../obj/wrtvec.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtvecsub.F90 > ../obj/wrtvecsub.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtvecsub.o ../obj/wrtvecsub.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/io/wrtxyz.F90 > ../obj/wrtxyz.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wrtxyz.o ../obj/wrtxyz.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/block.F90 > ../obj/block.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/block.o ../obj/block.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/denful.F90 > ../obj/denful.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/denful.o ../obj/denful.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/densub.F90 > ../obj/densub.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/densub.o ../obj/densub.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/densubfdm.F90 > ../obj/densubfdm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/densubfdm.o ../obj/densubfdm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/divcon.F90 > ../obj/divcon.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/divcon.o ../obj/divcon.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/geoopt_module.F90 > ../obj/geoopt_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/geoopt_module.o ../obj/geoopt_module.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/edriver.F90 > ../obj/edriver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/edriver.o ../obj/edriver.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/mosub.F90 > ../obj/mosub.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mosub.o ../obj/mosub.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/mosubfdm.F90 > ../obj/mosubfdm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mosubfdm.o ../obj/mosubfdm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/mosubfdmx.F90 > ../obj/mosubfdmx.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mosubfdmx.o ../obj/mosubfdmx.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/mainRdKeys.F90 > ../obj/mainRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mainRdKeys.o ../obj/mainRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/math/diag.F90 > ../obj/diag.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/diag.o ../obj/diag.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/math/diagp.F90 > ../obj/diagp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/diagp.o ../obj/diagp.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/math/fourier.F90 > ../obj/fourier.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/fourier.o ../obj/fourier.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/math/lsolve.F90 > ../obj/lsolve.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/lsolve.o ../obj/lsolve.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/math/math.F90 > ../obj/math.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/math.o ../obj/math.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/math/normalization.F90 > ../obj/normalization.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/normalization.o ../obj/normalization.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/math/pdsyevd_driver.F90 > ../obj/pdsyevd_driver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pdsyevd_driver.o ../obj/pdsyevd_driver.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/math/pdsyevx_driver.F90 > ../obj/pdsyevx_driver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pdsyevx_driver.o ../obj/pdsyevx_driver.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/math/zheev.F90 > ../obj/zheev.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/zheev.o ../obj/zheev.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/boxmove.F90 > ../obj/boxmove.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/boxmove.o ../obj/boxmove.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/boxstep.F90 > ../obj/boxstep.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/boxstep.o ../obj/boxstep.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/dovir.F90 > ../obj/dovir.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dovir.o ../obj/dovir.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/gcartmc.F90 > ../obj/gcartmc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/gcartmc.o ../obj/gcartmc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/getrforc.F90 > ../obj/getrforc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/getrforc.o ../obj/getrforc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/mccopy.F90 > ../obj/mccopy.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mccopy.o ../obj/mccopy.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/mcsetup.F90 > ../obj/mcsetup.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mcsetup.o ../obj/mcsetup.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/nptdriver.F90 > ../obj/nptdriver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/nptdriver.o ../obj/nptdriver.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/nvtdriver.F90 > ../obj/nvtdriver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/nvtdriver.o ../obj/nvtdriver.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/resmove.F90 > ../obj/resmove.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/resmove.o ../obj/resmove.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/resstep.F90 > ../obj/resstep.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/resstep.o ../obj/resstep.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/rottr.F90 > ../obj/rottr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rottr.o ../obj/rottr.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/setbox.F90 > ../obj/setbox.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/setbox.o ../obj/setbox.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mc/submove.F90 > ../obj/submove.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/submove.o ../obj/submove.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocatevars.F90 > ../obj/allocatevars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocatevars.o ../obj/allocatevars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/deallocatevars.F90 > ../obj/deallocatevars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/deallocatevars.o ../obj/deallocatevars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateDcVars.F90 > ../obj/allocateDcVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateDcVars.o ../obj/allocateDcVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateIntVars.F90 > ../obj/allocateIntVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateIntVars.o ../obj/allocateIntVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateMmVars.F90 > ../obj/allocateMmVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateMmVars.o ../obj/allocateMmVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateFreqVars.F90 > ../obj/allocateFreqVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateFreqVars.o ../obj/allocateFreqVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateGuessVars.F90 > ../obj/allocateGuessVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateGuessVars.o ../obj/allocateGuessVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateMcVars.F90 > ../obj/allocateMcVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateMcVars.o ../obj/allocateMcVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateMinVars.F90 > ../obj/allocateMinVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateMinVars.o ../obj/allocateMinVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateNmrVars.F90 > ../obj/allocateNmrVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateNmrVars.o ../obj/allocateNmrVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateParamVars.F90 > ../obj/allocateParamVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateParamVars.o ../obj/allocateParamVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocatePmeVars.F90 > ../obj/allocatePmeVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocatePmeVars.o ../obj/allocatePmeVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateScrfVars.F90 > ../obj/allocateScrfVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateScrfVars.o ../obj/allocateScrfVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateToolsVars.F90 > ../obj/allocateToolsVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateToolsVars.o ../obj/allocateToolsVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/bsrch.F90 > ../obj/bsrch.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/bsrch.o ../obj/bsrch.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/diislb.F90 > ../obj/diislb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/diislb.o ../obj/diislb.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/diisub.F90 > ../obj/diisub.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/diisub.o ../obj/diisub.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/geoopt.F90 > ../obj/geoopt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/geoopt.o ../obj/geoopt.f call system (command) ^ pathf95-1675 pathf90: WARNING GEOOPT, File = ../obj/geoopt.f, Line = 315, Column = 20 Intrinsic "SYSTEM" is a function, so this call to a subroutine will be treated as "external" pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:42:10 pathf95: 945 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/getdir.F90 > ../obj/getdir.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/getdir.o ../obj/getdir.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/lbfgs.F90 > ../obj/lbfgs.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/lbfgs.o ../obj/lbfgs.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/min/linmin.F90 > ../obj/linmin.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/linmin.o ../obj/linmin.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mm/getmm.F90 > ../obj/getmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/getmm.o ../obj/getmm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mm/getpep.F90 > ../obj/getpep.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/getpep.o ../obj/getpep.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mm/ljint.F90 > ../obj/ljint.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/ljint.o ../obj/ljint.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mm/mmroutines.F90 > ../obj/mmroutines.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mmroutines.o ../obj/mmroutines.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mm/restraint.F90 > ../obj/restraint.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/restraint.o ../obj/restraint.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mm/mmDriver.F90 > ../obj/mmDriver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mmDriver.o ../obj/mmDriver.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mpi/balance.F90 > ../obj/balance.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/balance.o ../obj/balance.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mpi/set_mpi_init.F90 > ../obj/set_mpi_init.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/set_mpi_init.o ../obj/set_mpi_init.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/assignbasis.F90 > ../obj/assignbasis.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/assignbasis.o ../obj/assignbasis.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/chshift.F90 > ../obj/chshift.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/chshift.o ../obj/chshift.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/nmrdenful.F90 > ../obj/nmrdenful.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/nmrdenful.o ../obj/nmrdenful.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/nmrdensub.F90 > ../obj/nmrdensub.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/nmrdensub.o ../obj/nmrdensub.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/nmrdmx.F90 > ../obj/nmrdmx.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/nmrdmx.o ../obj/nmrdmx.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/nmresqr.F90 > ../obj/nmresqr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/nmresqr.o ../obj/nmresqr.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/nmr/oethccs.F90 > ../obj/oethccs.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/oethccs.o ../obj/oethccs.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/param/coppnt.F90 > ../obj/coppnt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/coppnt.o ../obj/coppnt.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/param/error.F90 > ../obj/error.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/error.o ../obj/error.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/param/loop.F90 > ../obj/loop.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/loop.o ../obj/loop.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/param/parop2.F90 > ../obj/parop2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/parop2.o ../obj/parop2.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/param/parop.F90 > ../obj/parop.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/parop.o ../obj/parop.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/param/recalc.F90 > ../obj/recalc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/recalc.o ../obj/recalc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/param/tstpnt.F90 > ../obj/tstpnt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/tstpnt.o ../obj/tstpnt.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/chk_run_delphi.F90 > ../obj/chk_run_delphi.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/chk_run_delphi.o ../obj/chk_run_delphi.f call system (command) ^ pathf95-1675 pathf90: WARNING CHK_RUN_DELPHI, File = ../obj/chk_run_delphi.f, Line = 115, Column = 8 Intrinsic "SYSTEM" is a function, so this call to a subroutine will be treated as "external" pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:42:20 pathf95: 168 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/divpb.F90 > ../obj/divpb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/divpb.o ../obj/divpb.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpaccelerate.F90 > ../obj/dpaccelerate.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpaccelerate.o ../obj/dpaccelerate.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpchargegrid.F90 > ../obj/dpchargegrid.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpchargegrid.o ../obj/dpchargegrid.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpcollectsurfcharge.F90 > ../obj/dpcollectsurfcharge.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpcollectsurfcharge.o ../obj/dpcollectsurfcharge.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpfinesurfprep.F90 > ../obj/dpfinesurfprep.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpfinesurfprep.o ../obj/dpfinesurfprep.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpfinesurfacc.F90 > ../obj/dpfinesurfacc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpfinesurfacc.o ../obj/dpfinesurfacc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpfinesurfrelax.F90 > ../obj/dpfinesurfrelax.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpfinesurfrelax.o ../obj/dpfinesurfrelax.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpgetmol.F90 > ../obj/dpgetmol.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpgetmol.o ../obj/dpgetmol.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpinit.F90 > ../obj/dpinit.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpinit.o ../obj/dpinit.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dploop.F90 > ../obj/dploop.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dploop.o ../obj/dploop.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpmakegrid.F90 > ../obj/dpmakegrid.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpmakegrid.o ../obj/dpmakegrid.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpmakesurface.F90 > ../obj/dpmakesurface.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpmakesurface.o ../obj/dpmakesurface.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpsetepsilon.F90 > ../obj/dpsetepsilon.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpsetepsilon.o ../obj/dpsetepsilon.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/dpsetphi.F90 > ../obj/dpsetphi.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dpsetphi.o ../obj/dpsetphi.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/nonpolar2.F90 > ../obj/nonpolar2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/nonpolar2.o ../obj/nonpolar2.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/pbfock.F90 > ../obj/pbfock.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pbfock.o ../obj/pbfock.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/pb_mds.F90 > ../obj/pb_mds.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pb_mds.o ../obj/pb_mds.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/pb_putpnt.F90 > ../obj/pb_putpnt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pb_putpnt.o ../obj/pb_putpnt.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/pbsolver.F90 > ../obj/pbsolver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pbsolver.o ../obj/pbsolver.f call system (command) ^ pathf95-1675 pathf90: WARNING PBSOLVER, File = ../obj/pbsolver.f, Line = 204, Column = 14 Intrinsic "SYSTEM" is a function, so this call to a subroutine will be treated as "external" pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:42:27 pathf95: 324 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/pb_spt.F90 > ../obj/pb_spt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pb_spt.o ../obj/pb_spt.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/pb_subdiv.F90 > ../obj/pb_subdiv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pb_subdiv.o ../obj/pb_subdiv.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/pb_vector.F90 > ../obj/pb_vector.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pb_vector.o ../obj/pb_vector.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pb/pbDriver.F90 > ../obj/pbDriver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pbDriver.o ../obj/pbDriver.f if(bDmxExist) call system("mv divcon.dmx divcon.dmx.vac") ^ pathf95-1675 pathf90: WARNING PBDRIVER, File = ../obj/pbDriver.f, Line = 104, Column = 28 Intrinsic "SYSTEM" is a function, so this call to a subroutine will be treated as "external" pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:42:27 pathf95: 405 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_calcb.F90 > ../obj/pme_calcb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_calcb.o ../obj/pme_calcb.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_calcq.F90 > ../obj/pme_calcq.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_calcq.o ../obj/pme_calcq.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_calcqmc.F90 > ../obj/pme_calcqmc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_calcqmc.o ../obj/pme_calcqmc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_calctheta.F90 > ../obj/pme_calctheta.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_calctheta.o ../obj/pme_calctheta.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_derec.F90 > ../obj/pme_derec.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_derec.o ../obj/pme_derec.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_derecmc.F90 > ../obj/pme_derecmc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_derecmc.o ../obj/pme_derecmc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_direct.F90 > ../obj/pme_direct.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_direct.o ../obj/pme_direct.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_directmc.F90 > ../obj/pme_directmc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_directmc.o ../obj/pme_directmc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_erec.F90 > ../obj/pme_erec.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_erec.o ../obj/pme_erec.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_erecmc.F90 > ../obj/pme_erecmc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_erecmc.o ../obj/pme_erecmc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_recip.F90 > ../obj/pme_recip.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_recip.o ../obj/pme_recip.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_recipmc.F90 > ../obj/pme_recipmc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_recipmc.o ../obj/pme_recipmc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pme_setup.F90 > ../obj/pme_setup.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pme_setup.o ../obj/pme_setup.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/pme/pmeDriver.F90 > ../obj/pmeDriver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pmeDriver.o ../obj/pmeDriver.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/scf/fmix.F90 > ../obj/fmix.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/fmix.o ../obj/fmix.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/scf/escf.F90 > ../obj/escf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/escf.o ../obj/escf.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/scf/initp.F90 > ../obj/initp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/initp.o ../obj/initp.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/scf/pmix.F90 > ../obj/pmix.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pmix.o ../obj/pmix.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/assign.F90 > ../obj/assign.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/assign.o ../obj/assign.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/atmlist.F90 > ../obj/atmlist.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/atmlist.o ../obj/atmlist.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/glbpnt.F90 > ../obj/glbpnt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/glbpnt.o ../obj/glbpnt.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/initializeVars.F90 > ../obj/initializeVars.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/initializeVars.o ../obj/initializeVars.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/intpr.F90 > ../obj/intpr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/intpr.o ../obj/intpr.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/setdef.F90 > ../obj/setdef.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/setdef.o ../obj/setdef.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/setname2.F90 > ../obj/setname2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/setname2.o ../obj/setname2.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/setopt.F90 > ../obj/setopt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/setopt.o ../obj/setopt.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/setup.F90 > ../obj/setup.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/setup.o ../obj/setup.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/stripkeywd.F90 > ../obj/stripkeywd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/stripkeywd.o ../obj/stripkeywd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/atmchg.F90 > ../obj/atmchg.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/atmchg.o ../obj/atmchg.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/bcheck.F90 > ../obj/bcheck.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/bcheck.o ../obj/bcheck.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/dipole.F90 > ../obj/dipole.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dipole.o ../obj/dipole.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/homolumo.F90 > ../obj/homolumo.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/homolumo.o ../obj/homolumo.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/mkdos.F90 > ../obj/mkdos.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mkdos.o ../obj/mkdos.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/push.F90 > ../obj/push.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/push.o ../obj/push.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/pwdecomp.F90 > ../obj/pwdecomp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pwdecomp.o ../obj/pwdecomp.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/rotate.F90 > ../obj/rotate.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rotate.o ../obj/rotate.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/thermo.F90 > ../obj/thermo.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/thermo.o ../obj/thermo.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/toolsRdKeys.F90 > ../obj/toolsRdKeys.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/toolsRdKeys.o ../obj/toolsRdKeys.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/toolsRdTail.F90 > ../obj/toolsRdTail.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/toolsRdTail.o ../obj/toolsRdTail.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/toolsDriver.F90 > ../obj/toolsDriver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/toolsDriver.o ../obj/toolsDriver.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/tools/rderror.F90 > ../obj/rderror.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rderror.o ../obj/rderror.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ts/geots.F90 > ../obj/geots.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/geots.o ../obj/geots.f call system (command) ^ pathf95-1675 pathf90: WARNING GEOTS, File = ../obj/geots.f, Line = 232, Column = 20 Intrinsic "SYSTEM" is a function, so this call to a subroutine will be treated as "external" pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:42:38 pathf95: 258 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ts/prjfc.F90 > ../obj/prjfc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/prjfc.o ../obj/prjfc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ts/septs.F90 > ../obj/septs.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/septs.o ../obj/septs.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ts/tsqna.F90 > ../obj/tsqna.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/tsqna.o ../obj/tsqna.f call system (command) ^ pathf95-1675 pathf90: WARNING TSQNA, File = ../obj/tsqna.f, Line = 243, Column = 20 Intrinsic "SYSTEM" is a function, so this call to a subroutine will be treated as "external" pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:42:40 pathf95: 887 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/ts/tsrfo.F90 > ../obj/tsrfo.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/tsrfo.o ../obj/tsrfo.f call system (command) ^ pathf95-1675 pathf90: WARNING TSRFO, File = ../obj/tsrfo.f, Line = 246, Column = 20 Intrinsic "SYSTEM" is a function, so this call to a subroutine will be treated as "external" pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:42:41 pathf95: 898 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/av.F90 > ../obj/av.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/av.o ../obj/av.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/binloc_index.F90 > ../obj/binloc_index.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/binloc_index.o ../obj/binloc_index.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/bleng.F90 > ../obj/bleng.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/bleng.o ../obj/bleng.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/bndang.F90 > ../obj/bndang.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/bndang.o ../obj/bndang.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/bpair.F90 > ../obj/bpair.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/bpair.o ../obj/bpair.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/bsort.F90 > ../obj/bsort.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/bsort.o ../obj/bsort.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/bspline.F90 > ../obj/bspline.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/bspline.o ../obj/bspline.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/calcgeo.F90 > ../obj/calcgeo.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/calcgeo.o ../obj/calcgeo.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/chkovlp.F90 > ../obj/chkovlp.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/chkovlp.o ../obj/chkovlp.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/diffp_stat.F90 > ../obj/diffp_stat.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/diffp_stat.o ../obj/diffp_stat.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/dihedr.F90 > ../obj/dihedr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dihedr.o ../obj/dihedr.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/dograd.F90 > ../obj/dograd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dograd.o ../obj/dograd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/etimer.F90 > ../obj/etimer.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/etimer.o ../obj/etimer.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/g2int.F90 > ../obj/g2int.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/g2int.o ../obj/g2int.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/gcart.F90 > ../obj/gcart.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/gcart.o ../obj/gcart.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/getcrd.F90 > ../obj/getcrd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/getcrd.o ../obj/getcrd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/getpar2.F90 > ../obj/getpar2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/getpar2.o ../obj/getpar2.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/getpar.F90 > ../obj/getpar.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/getpar.o ../obj/getpar.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/getxyz.F90 > ../obj/getxyz.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/getxyz.o ../obj/getxyz.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/icoord.F90 > ../obj/icoord.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/icoord.o ../obj/icoord.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/ijpair.F90 > ../obj/ijpair.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/ijpair.o ../obj/ijpair.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/mcweeny.F90 > ../obj/mcweeny.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mcweeny.o ../obj/mcweeny.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/mvcrd.F90 > ../obj/mvcrd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/mvcrd.o ../obj/mvcrd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/namemcf.F90 > ../obj/namemcf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/namemcf.o ../obj/namemcf.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/int/oned.F90 > ../obj/oned.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/oned.o ../obj/oned.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/opnfil.F90 > ../obj/opnfil.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/opnfil.o ../obj/opnfil.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/out2stream.F90 > ../obj/out2stream.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/out2stream.o ../obj/out2stream.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/out2xml.F90 > ../obj/out2xml.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/out2xml.o ../obj/out2xml.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/pbcxyz.F90 > ../obj/pbcxyz.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/pbcxyz.o ../obj/pbcxyz.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/random.F90 > ../obj/random.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/random.o ../obj/random.f FUNCTION xrandom(idum) ^ pathf95-287 pathf90: WARNING XRANDOM, File = ../obj/random.f, Line = 11, Column = 10 The result of function name "XRANDOM" in the function subprogram is not defined. FUNCTION irandom(idum,imax) ^ pathf95-287 pathf90: WARNING IRANDOM, File = ../obj/random.f, Line = 21, Column = 10 The result of function name "IRANDOM" in the function subprogram is not defined. sum = sum + xrandom(idum) ^ pathf95-1294 pathf90: WARNING GRANDOM, File = ../obj/random.f, Line = 46, Column = 6 Function "XRANDOM" is defined at line 11 (../obj/random.f). Type and rank for result "XRANDOM" differ at this definition or reference. pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:42:50 pathf95: 65 source lines pathf95: 0 Error(s), 3 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/rcalc.F90 > ../obj/rcalc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rcalc.o ../obj/rcalc.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/setprtvec.F90 > ../obj/setprtvec.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/setprtvec.o ../obj/setprtvec.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/setunit.F90 > ../obj/setunit.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/setunit.o ../obj/setunit.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/strcatf.F90 > ../obj/strcatf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/strcatf.o ../obj/strcatf.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/upcase.F90 > ../obj/upcase.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/upcase.o ../obj/upcase.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/updatefname.F90 > ../obj/updatefname.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/updatefname.o ../obj/updatefname.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/wdjoin.F90 > ../obj/wdjoin.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/wdjoin.o ../obj/wdjoin.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/whatis.F90 > ../obj/whatis.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/whatis.o ../obj/whatis.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/util/zmake.F90 > ../obj/zmake.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/zmake.o ../obj/zmake.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/qm_mm_div.F90 > ../obj/qm_mm_div.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/qm_mm_div.o ../obj/qm_mm_div.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/hcorecl.F90 > ../obj/hcorecl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/hcorecl.o ../obj/hcorecl.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/tran.F90 > ../obj/tran.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/tran.o ../obj/tran.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/computeDimSizesqmmm.F90 > ../obj/computeDimSizesqmmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/computeDimSizesqmmm.o ../obj/computeDimSizesqmmm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/transd.F90 > ../obj/transd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/transd.o ../obj/transd.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/gcartcl.F90 > ../obj/gcartcl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/gcartcl.o ../obj/gcartcl.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/dcartcl.F90 > ../obj/dcartcl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/dcartcl.o ../obj/dcartcl.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/analytcl.F90 > ../obj/analytcl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/analytcl.o ../obj/analytcl.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/rotatcl.F90 > ../obj/rotatcl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rotatcl.o ../obj/rotatcl.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/delricl.F90 > ../obj/delricl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/delricl.o ../obj/delricl.f DATA ICALCN/0/ ^ pathf95-1542 pathf90: WARNING DELRICL, File = ../obj/delricl.f, Line = 44, Column = 12 Initializing a named common block member in a program unit other than a block data is not legal for this architecture. pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:42:53 pathf95: 74 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/delmolcl.F90 > ../obj/delmolcl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/delmolcl.o ../obj/delmolcl.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/rotatecl.F90 > ../obj/rotatecl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/rotatecl.o ../obj/rotatecl.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/reppcl.F90 > ../obj/reppcl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/reppcl.o ../obj/reppcl.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/initmem.F90 > ../obj/initmem.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/initmem.o ../obj/initmem.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/main/energyqmmm.F90 > ../obj/energyqmmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/energyqmmm.o ../obj/energyqmmm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/scf/doscfqmmm.F90 > ../obj/doscfqmmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/doscfqmmm.o ../obj/doscfqmmm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/scf/fockqmmm.F90 > ../obj/fockqmmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/fockqmmm.o ../obj/fockqmmm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/setup/commandqmmm.F90 > ../obj/commandqmmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/commandqmmm.o ../obj/commandqmmm.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/qmmm/initmem2.F90 > ../obj/initmem2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/initmem2.o ../obj/initmem2.f pathf90 -cpp -E -P -DHAS_LAPACK -I../src/include ../src/mem/allocateMxAtomVarsqmmm.F90 > ../obj/allocateMxAtomVarsqmmm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -I../../sander -o ../obj/allocateMxAtomVarsqmmm.o ../obj/allocateMxAtomVarsqmmm.f ar rv libdivcon.a ../obj/chgRdKeys.o ../obj/ioRdKeys.o ../obj/ioRdTail.o ../obj/dcRdKeys.o ../obj/dcRdTail.o ../obj/mcRdKeys.o ../obj/minRdKeys.o ../obj/minRdTail.o ../obj/mmRdKeys.o ../obj/mmRdTail.o ../obj/nmrRdKeys.o ../obj/nmrRdTail.o ../obj/paramRdKeys.o ../obj/pbRdKeys.o ../obj/pmeRdKeys.o ../obj/scfRdKeys.o ../obj/tsRdKeys.o ../obj/atgrid.o ../obj/chkres.o ../obj/clustsub.o ../obj/cmbcore.o ../obj/cmbsub.o ../obj/doferm.o ../obj/esqr.o ../obj/esqrfdm.o ../obj/frmchk.o ../obj/fshift.o ../obj/gensub.o ../obj/gridafnc.o ../obj/gridrfnc.o ../obj/mixgrid.o ../obj/mkgrid.o ../obj/pgridafnc.o ../obj/pgridrfnc.o ../obj/resgrid.o ../obj/setncell.o ../obj/sproc.o ../obj/dc_module.o ../obj/freq.o ../obj/hsep.o ../obj/freqRdKeys.o ../obj/freqRdTail.o ../obj/freq_module.o ../obj/hamRdKeys.o ../obj/mndo_module.o ../obj/am1_module.o ../obj/pm3_module.o ../obj/mndod_module.o ../obj/pddgpm3_module.o ../obj/aijm.o ../obj/attrecurse.o ../obj/ddpo.o ../obj/diat.o ../obj/ecd.o ../obj/electricfield.o ../obj/erecursive.o ../obj/FmT.o ../obj/inighd.o ../obj/intdd1.o ../obj/intdd2.o ../obj/intdd3.o ../obj/intdd4.o ../obj/intdd5.o ../obj/intdd6.o ../obj/intdd.o ../obj/intdp.o ../obj/intds.o ../obj/intpd.o ../obj/intsd.o ../obj/localdd.o ../obj/localdp.o ../obj/localds.o ../obj/localpd.o ../obj/localsd.o ../obj/overlap.o ../obj/overlp.o ../obj/repuld.o ../obj/repul.o ../obj/sabt.o ../obj/setdorb.o ../obj/slow.o ../obj/slowi.o ../obj/intRdKeys.o ../obj/int_module.o ../obj/getversion.o ../obj/header.o ../obj/printen.o ../obj/printpar.o ../obj/printsub.o ../obj/rdcoord.o ../obj/rdbelly.o ../obj/rdbox.o ../obj/rdchemix.o ../obj/rdcluster.o ../obj/rdcomb.o ../obj/rddmx.o ../obj/rddos.o ../obj/rdgrid.o ../obj/rdgroup.o ../obj/rdguess.o ../obj/rdhess.o ../obj/rdint.o ../obj/rdkeys.o ../obj/rdlist.o ../obj/rdneighb.o ../obj/rdnext.o ../obj/rdnmr.o ../obj/rdnum.o ../obj/rdpdb.o ../obj/rdprtvec.o ../obj/rdrestraints.o ../obj/rdrst.o ../obj/rdsub.o ../obj/rdtail.o ../obj/rdvdw.o ../obj/rdword.o ../obj/rdxyz.o ../obj/wrtchg.o ../obj/wrtcoor.o ../obj/wrtdefaultkeys.o ../obj/wrtdiv.o ../obj/wrtdmx.o ../obj/wrtgrd.o ../obj/wrthss.o ../obj/wrtint.o ../obj/wrtpdb.o ../obj/wrtqma.o ../obj/wrtrep.o ../obj/wrtrst.o ../obj/wrttim.o ../obj/wrtvec.o ../obj/wrtvecsub.o ../obj/wrtxyz.o ../obj/block.o ../obj/denful.o ../obj/densub.o ../obj/densubfdm.o ../obj/divcon.o ../obj/edriver.o ../obj/global_module.o ../obj/param_module.o ../obj/math_module.o ../obj/pme_module.o ../obj/mm_module.o ../obj/nmr_module.o ../obj/mosub.o ../obj/mosubfdm.o ../obj/mosubfdmx.o ../obj/mainRdKeys.o ../obj/element_module.o ../obj/diag.o ../obj/diagp.o ../obj/fourier.o ../obj/lsolve.o ../obj/math.o ../obj/normalization.o ../obj/pdsyevd_driver.o ../obj/pdsyevx_driver.o ../obj/zheev.o ../obj/boxmove.o ../obj/boxstep.o ../obj/dovir.o ../obj/gcartmc.o ../obj/getrforc.o ../obj/mccopy.o ../obj/mcsetup.o ../obj/nptdriver.o ../obj/nvtdriver.o ../obj/resmove.o ../obj/resstep.o ../obj/rottr.o ../obj/setbox.o ../obj/submove.o ../obj/mc_module.o ../obj/allocatevars.o ../obj/deallocatevars.o ../obj/allocateDcVars.o ../obj/allocateIntVars.o ../obj/allocateMmVars.o ../obj/allocateFreqVars.o ../obj/allocateGuessVars.o ../obj/allocateMcVars.o ../obj/allocateMinVars.o ../obj/allocateNmrVars.o ../obj/allocateParamVars.o ../obj/allocatePmeVars.o ../obj/allocateScrfVars.o ../obj/allocateToolsVars.o ../obj/bsrch.o ../obj/diislb.o ../obj/diisub.o ../obj/geoopt.o ../obj/geoopt_module.o ../obj/getdir.o ../obj/lbfgs.o ../obj/linmin.o ../obj/min_module.o ../obj/getmm.o ../obj/getpep.o ../obj/ljglobals.o ../obj/ljint.o ../obj/mmroutines.o ../obj/restraint.o ../obj/mmDriver.o ../obj/balance.o ../obj/set_mpi_init.o ../obj/assignbasis.o ../obj/chshift.o ../obj/nmrdenful.o ../obj/nmrdensub.o ../obj/nmrdmx.o ../obj/nmresqr.o ../obj/oethccs.o ../obj/mndonmr_module.o ../obj/coppnt.o ../obj/error.o ../obj/loop.o ../obj/parop2.o ../obj/parop.o ../obj/recalc.o ../obj/tstpnt.o ../obj/chk_run_delphi.o ../obj/divpb.o ../obj/dpaccelerate.o ../obj/dpchargegrid.o ../obj/dpcollectsurfcharge.o ../obj/dpfinesurfprep.o ../obj/dpfinesurfacc.o ../obj/dpfinesurfrelax.o ../obj/dpgetmol.o ../obj/dpinit.o ../obj/dploop.o ../obj/dpmakegrid.o ../obj/dpmakesurface.o ../obj/dpmodule.o ../obj/dpsetepsilon.o ../obj/dpsetphi.o ../obj/nonpolar2.o ../obj/pbfock.o ../obj/pb_mds.o ../obj/pb_putpnt.o ../obj/pbsolver.o ../obj/pb_spt.o ../obj/pb_subdiv.o ../obj/pb_vector.o ../obj/pbDriver.o ../obj/pme_calcb.o ../obj/pme_calcq.o ../obj/pme_calcqmc.o ../obj/pme_calctheta.o ../obj/pme_derec.o ../obj/pme_derecmc.o ../obj/pme_direct.o ../obj/pme_directmc.o ../obj/pme_erec.o ../obj/pme_erecmc.o ../obj/pme_recip.o ../obj/pme_recipmc.o ../obj/pme_setup.o ../obj/pmeDriver.o ../obj/fmix.o ../obj/escf.o ../obj/initp.o ../obj/pmix.o ../obj/scf_module.o ../obj/assign.o ../obj/atmlist.o ../obj/glbpnt.o ../obj/initializeVars.o ../obj/intpr.o ../obj/setdef.o ../obj/setname2.o ../obj/setopt.o ../obj/setup.o ../obj/stripkeywd.o ../obj/atmchg.o ../obj/bcheck.o ../obj/dipole.o ../obj/homolumo.o ../obj/mkdos.o ../obj/push.o ../obj/pwdecomp.o ../obj/rotate.o ../obj/thermo.o ../obj/toolsRdKeys.o ../obj/toolsRdTail.o ../obj/tools_module.o ../obj/toolsDriver.o ../obj/rderror.o ../obj/error_module.o ../obj/geots.o ../obj/prjfc.o ../obj/septs.o ../obj/tsqna.o ../obj/tsrfo.o ../obj/ts_module.o ../obj/av.o ../obj/binloc_index.o ../obj/bleng.o ../obj/bndang.o ../obj/bpair.o ../obj/bsort.o ../obj/bspline.o ../obj/calcgeo.o ../obj/chkovlp.o ../obj/diffp_stat.o ../obj/dihedr.o ../obj/dograd.o ../obj/etimer.o ../obj/g2int.o ../obj/gcart.o ../obj/getcrd.o ../obj/getpar2.o ../obj/getpar.o ../obj/getxyz.o ../obj/icoord.o ../obj/ijpair.o ../obj/mcweeny.o ../obj/mvcrd.o ../obj/namemcf.o ../obj/oned.o ../obj/opnfil.o ../obj/out2stream.o ../obj/out2xml.o ../obj/pbcxyz.o ../obj/random.o ../obj/rcalc.o ../obj/save_module.o ../obj/setprtvec.o ../obj/setunit.o ../obj/strcatf.o ../obj/upcase.o ../obj/updatefname.o ../obj/wdjoin.o ../obj/whatis.o ../obj/zmake.o ../obj/qm_mm_div.o ../obj/hcorecl.o ../obj/tran.o ../obj/computeDimSizesqmmm.o ../obj/transd.o ../obj/gcartcl.o ../obj/dcartcl.o ../obj/analytcl.o ../obj/rotatcl.o ../obj/delricl.o ../obj/delmolcl.o ../obj/rotatecl.o ../obj/reppcl.o ../obj/initmem.o ../obj/energyqmmm.o ../obj/doscfqmmm.o ../obj/fockqmmm.o ../obj/commandqmmm.o ../obj/initmem2.o ../obj/allocateMxAtomVarsqmmm.o ar: creating libdivcon.a a - ../obj/chgRdKeys.o a - ../obj/ioRdKeys.o a - ../obj/ioRdTail.o a - ../obj/dcRdKeys.o a - ../obj/dcRdTail.o a - ../obj/mcRdKeys.o a - ../obj/minRdKeys.o a - ../obj/minRdTail.o a - ../obj/mmRdKeys.o a - ../obj/mmRdTail.o a - ../obj/nmrRdKeys.o a - ../obj/nmrRdTail.o a - ../obj/paramRdKeys.o a - ../obj/pbRdKeys.o a - ../obj/pmeRdKeys.o a - ../obj/scfRdKeys.o a - ../obj/tsRdKeys.o a - ../obj/atgrid.o a - ../obj/chkres.o a - ../obj/clustsub.o a - ../obj/cmbcore.o a - ../obj/cmbsub.o a - ../obj/doferm.o a - ../obj/esqr.o a - ../obj/esqrfdm.o a - ../obj/frmchk.o a - ../obj/fshift.o a - ../obj/gensub.o a - ../obj/gridafnc.o a - ../obj/gridrfnc.o a - ../obj/mixgrid.o a - ../obj/mkgrid.o a - ../obj/pgridafnc.o a - ../obj/pgridrfnc.o a - ../obj/resgrid.o a - ../obj/setncell.o a - ../obj/sproc.o a - ../obj/dc_module.o a - ../obj/freq.o a - ../obj/hsep.o a - ../obj/freqRdKeys.o a - ../obj/freqRdTail.o a - ../obj/freq_module.o a - ../obj/hamRdKeys.o a - ../obj/mndo_module.o a - ../obj/am1_module.o a - ../obj/pm3_module.o a - ../obj/mndod_module.o a - ../obj/pddgpm3_module.o a - ../obj/aijm.o a - ../obj/attrecurse.o a - ../obj/ddpo.o a - ../obj/diat.o a - ../obj/ecd.o a - ../obj/electricfield.o a - ../obj/erecursive.o a - ../obj/FmT.o a - ../obj/inighd.o a - ../obj/intdd1.o a - ../obj/intdd2.o a - ../obj/intdd3.o a - ../obj/intdd4.o a - ../obj/intdd5.o a - ../obj/intdd6.o a - ../obj/intdd.o a - ../obj/intdp.o a - ../obj/intds.o a - ../obj/intpd.o a - ../obj/intsd.o a - ../obj/localdd.o a - ../obj/localdp.o a - ../obj/localds.o a - ../obj/localpd.o a - ../obj/localsd.o a - ../obj/overlap.o a - ../obj/overlp.o a - ../obj/repuld.o a - ../obj/repul.o a - ../obj/sabt.o a - ../obj/setdorb.o a - ../obj/slow.o a - ../obj/slowi.o a - ../obj/intRdKeys.o a - ../obj/int_module.o a - ../obj/getversion.o a - ../obj/header.o a - ../obj/printen.o a - ../obj/printpar.o a - ../obj/printsub.o a - ../obj/rdcoord.o a - ../obj/rdbelly.o a - ../obj/rdbox.o a - ../obj/rdchemix.o a - ../obj/rdcluster.o a - ../obj/rdcomb.o a - ../obj/rddmx.o a - ../obj/rddos.o a - ../obj/rdgrid.o a - ../obj/rdgroup.o a - ../obj/rdguess.o a - ../obj/rdhess.o a - ../obj/rdint.o a - ../obj/rdkeys.o a - ../obj/rdlist.o a - ../obj/rdneighb.o a - ../obj/rdnext.o a - ../obj/rdnmr.o a - ../obj/rdnum.o a - ../obj/rdpdb.o a - ../obj/rdprtvec.o a - ../obj/rdrestraints.o a - ../obj/rdrst.o a - ../obj/rdsub.o a - ../obj/rdtail.o a - ../obj/rdvdw.o a - ../obj/rdword.o a - ../obj/rdxyz.o a - ../obj/wrtchg.o a - ../obj/wrtcoor.o a - ../obj/wrtdefaultkeys.o a - ../obj/wrtdiv.o a - ../obj/wrtdmx.o a - ../obj/wrtgrd.o a - ../obj/wrthss.o a - ../obj/wrtint.o a - ../obj/wrtpdb.o a - ../obj/wrtqma.o a - ../obj/wrtrep.o a - ../obj/wrtrst.o a - ../obj/wrttim.o a - ../obj/wrtvec.o a - ../obj/wrtvecsub.o a - ../obj/wrtxyz.o a - ../obj/block.o a - ../obj/denful.o a - ../obj/densub.o a - ../obj/densubfdm.o a - ../obj/divcon.o a - ../obj/edriver.o a - ../obj/global_module.o a - ../obj/param_module.o a - ../obj/math_module.o a - ../obj/pme_module.o a - ../obj/mm_module.o a - ../obj/nmr_module.o a - ../obj/mosub.o a - ../obj/mosubfdm.o a - ../obj/mosubfdmx.o a - ../obj/mainRdKeys.o a - ../obj/element_module.o a - ../obj/diag.o a - ../obj/diagp.o a - ../obj/fourier.o a - ../obj/lsolve.o a - ../obj/math.o a - ../obj/normalization.o a - ../obj/pdsyevd_driver.o a - ../obj/pdsyevx_driver.o a - ../obj/zheev.o a - ../obj/boxmove.o a - ../obj/boxstep.o a - ../obj/dovir.o a - ../obj/gcartmc.o a - ../obj/getrforc.o a - ../obj/mccopy.o a - ../obj/mcsetup.o a - ../obj/nptdriver.o a - ../obj/nvtdriver.o a - ../obj/resmove.o a - ../obj/resstep.o a - ../obj/rottr.o a - ../obj/setbox.o a - ../obj/submove.o a - ../obj/mc_module.o a - ../obj/allocatevars.o a - ../obj/deallocatevars.o a - ../obj/allocateDcVars.o a - ../obj/allocateIntVars.o a - ../obj/allocateMmVars.o a - ../obj/allocateFreqVars.o a - ../obj/allocateGuessVars.o a - ../obj/allocateMcVars.o a - ../obj/allocateMinVars.o a - ../obj/allocateNmrVars.o a - ../obj/allocateParamVars.o a - ../obj/allocatePmeVars.o a - ../obj/allocateScrfVars.o a - ../obj/allocateToolsVars.o a - ../obj/bsrch.o a - ../obj/diislb.o a - ../obj/diisub.o a - ../obj/geoopt.o a - ../obj/geoopt_module.o a - ../obj/getdir.o a - ../obj/lbfgs.o a - ../obj/linmin.o a - ../obj/min_module.o a - ../obj/getmm.o a - ../obj/getpep.o a - ../obj/ljglobals.o a - ../obj/ljint.o a - ../obj/mmroutines.o a - ../obj/restraint.o a - ../obj/mmDriver.o a - ../obj/balance.o a - ../obj/set_mpi_init.o a - ../obj/assignbasis.o a - ../obj/chshift.o a - ../obj/nmrdenful.o a - ../obj/nmrdensub.o a - ../obj/nmrdmx.o a - ../obj/nmresqr.o a - ../obj/oethccs.o a - ../obj/mndonmr_module.o a - ../obj/coppnt.o a - ../obj/error.o a - ../obj/loop.o a - ../obj/parop2.o a - ../obj/parop.o a - ../obj/recalc.o a - ../obj/tstpnt.o a - ../obj/chk_run_delphi.o a - ../obj/divpb.o a - ../obj/dpaccelerate.o a - ../obj/dpchargegrid.o a - ../obj/dpcollectsurfcharge.o a - ../obj/dpfinesurfprep.o a - ../obj/dpfinesurfacc.o a - ../obj/dpfinesurfrelax.o a - ../obj/dpgetmol.o a - ../obj/dpinit.o a - ../obj/dploop.o a - ../obj/dpmakegrid.o a - ../obj/dpmakesurface.o a - ../obj/dpmodule.o a - ../obj/dpsetepsilon.o a - ../obj/dpsetphi.o a - ../obj/nonpolar2.o a - ../obj/pbfock.o a - ../obj/pb_mds.o a - ../obj/pb_putpnt.o a - ../obj/pbsolver.o a - ../obj/pb_spt.o a - ../obj/pb_subdiv.o a - ../obj/pb_vector.o a - ../obj/pbDriver.o a - ../obj/pme_calcb.o a - ../obj/pme_calcq.o a - ../obj/pme_calcqmc.o a - ../obj/pme_calctheta.o a - ../obj/pme_derec.o a - ../obj/pme_derecmc.o a - ../obj/pme_direct.o a - ../obj/pme_directmc.o a - ../obj/pme_erec.o a - ../obj/pme_erecmc.o a - ../obj/pme_recip.o a - ../obj/pme_recipmc.o a - ../obj/pme_setup.o a - ../obj/pmeDriver.o a - ../obj/fmix.o a - ../obj/escf.o a - ../obj/initp.o a - ../obj/pmix.o a - ../obj/scf_module.o a - ../obj/assign.o a - ../obj/atmlist.o a - ../obj/glbpnt.o a - ../obj/initializeVars.o a - ../obj/intpr.o a - ../obj/setdef.o a - ../obj/setname2.o a - ../obj/setopt.o a - ../obj/setup.o a - ../obj/stripkeywd.o a - ../obj/atmchg.o a - ../obj/bcheck.o a - ../obj/dipole.o a - ../obj/homolumo.o a - ../obj/mkdos.o a - ../obj/push.o a - ../obj/pwdecomp.o a - ../obj/rotate.o a - ../obj/thermo.o a - ../obj/toolsRdKeys.o a - ../obj/toolsRdTail.o a - ../obj/tools_module.o a - ../obj/toolsDriver.o a - ../obj/rderror.o a - ../obj/error_module.o a - ../obj/geots.o a - ../obj/prjfc.o a - ../obj/septs.o a - ../obj/tsqna.o a - ../obj/tsrfo.o a - ../obj/ts_module.o a - ../obj/av.o a - ../obj/binloc_index.o a - ../obj/bleng.o a - ../obj/bndang.o a - ../obj/bpair.o a - ../obj/bsort.o a - ../obj/bspline.o a - ../obj/calcgeo.o a - ../obj/chkovlp.o a - ../obj/diffp_stat.o a - ../obj/dihedr.o a - ../obj/dograd.o a - ../obj/etimer.o a - ../obj/g2int.o a - ../obj/gcart.o a - ../obj/getcrd.o a - ../obj/getpar2.o a - ../obj/getpar.o a - ../obj/getxyz.o a - ../obj/icoord.o a - ../obj/ijpair.o a - ../obj/mcweeny.o a - ../obj/mvcrd.o a - ../obj/namemcf.o a - ../obj/oned.o a - ../obj/opnfil.o a - ../obj/out2stream.o a - ../obj/out2xml.o a - ../obj/pbcxyz.o a - ../obj/random.o a - ../obj/rcalc.o a - ../obj/save_module.o a - ../obj/setprtvec.o a - ../obj/setunit.o a - ../obj/strcatf.o a - ../obj/upcase.o a - ../obj/updatefname.o a - ../obj/wdjoin.o a - ../obj/whatis.o a - ../obj/zmake.o a - ../obj/qm_mm_div.o a - ../obj/hcorecl.o a - ../obj/tran.o a - ../obj/computeDimSizesqmmm.o a - ../obj/transd.o a - ../obj/gcartcl.o a - ../obj/dcartcl.o a - ../obj/analytcl.o a - ../obj/rotatcl.o a - ../obj/delricl.o a - ../obj/delmolcl.o a - ../obj/rotatecl.o a - ../obj/reppcl.o a - ../obj/initmem.o a - ../obj/energyqmmm.o a - ../obj/doscfqmmm.o a - ../obj/fockqmmm.o a - ../obj/commandqmmm.o a - ../obj/initmem2.o a - ../obj/allocateMxAtomVarsqmmm.o ranlib libdivcon.a mv libdivcon.a ../src/qmmm/ make[3]: Leaving directory `/usr/local/amber9/src/dcqtp/mod' make[2]: Leaving directory `/usr/local/amber9/src/dcqtp' pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -freeform -o sander evb_vars.o evb_input.o evb_init.o evb_alloc.o evb_dealloc.o check_input.o evb_io.o evb_keywrd.o exchange_CM.o evb_mcp.o evb_force.o diabatic.o evb_2stdebug.o egap_umb_2stdebug.o exchange_gauss.o exchange_warshel.o morsify.o morse_anal2num.o evb_matrix.o evb_ntrfc.o out_evb.o constants.o stack.o qmmm_module.o trace.o lmod.o decomp.o icosasurf.o egb.o findmask.o pb_force.o pb_exmol.o pb_mpfrc.o pb_direct.o pb_list.o np_force.o sa_driver.o relax_mat.o nmr.o multisander.o sander.o trajene.o cshf.o nmrcal.o pearsn.o printe.o runmin.o rdparm.o mdread.o locmem.o runmd.o getcor.o degcnt.o decnvh.o fastwt.o parallel.o shake.o ene.o mdwrit.o minrit.o set.o dynlib.o mdfil.o nmlsrc.o ew_force.o ew_setup.o ew_box.o ew_bspline.o ew_fft.o nonbond_list.o short_ene.o ew_recip.o pcshift.o align.o rfree.o rgroup.o random.o amopen.o debug.o ew_recip_reg.o ew_handle_dips.o ew_dipole_recip.o mexit.o new_time.o extra_pts.o thermo_int.o matinv.o assert.o mmtsb.o mmtsb_client.o erfcfun.o veclib.o is_init.o constantph.o prn_dipoles.o ips.o sglds.o amoeba_valence.o amoeba_multipoles.o amoeba_recip.o amoeba_interface.o amoeba_direct.o amoeba_mdin.o amoeba_adjust.o amoeba_self.o amoeba_vdw.o amoeba_induced.o amoeba_runmd.o bintraj.o spatial_recip.o spatial_fft.o parms.o qm_mm.o qm_link_atoms.o qm_nb_list.o qm_extract_coords.o qm_ewald.o qm_gb.o qm_zero_charges.o qm_print_info.o qm_assign_atom_types.o qm2_allocate_e_repul.o qm2_calc_charges.o qm2_calc_rij_and_eqns.o qm2_dihed.o qm2_energy.o qm2_fock.o qm2_get_qm_forces.o qm2_get_qmmm_forces.o qm2_h1elec.o qm2_hcore_qmqm.o qm2_hcore_qmmm.o qm2_identify_peptide_links.o qm2_load_params_and_allocate.o qm2_repp.o qm2_rotate_qmqm.o qm2_scf.o qm2_setup_orb_exp.o qm2_smallest_number.o qm2_dftb_module.o qm2_dftb_broyden.o qm2_dftb_dispersion_egr.o qm2_dftb_dispersion_params.o qm2_dftb_dispersionread.o qm2_dftb_eglcao.o qm2_dftb_energy.o qm2_dftb_ewevge.o qm2_dftb_externalchgrad.o qm2_dftb_externalshift.o qm2_dftb_fermi.o qm2_dftb_forces.o qm2_dftb_gamma.o qm2_dftb_gammamat.o qm2_dftb_get_qmmm_forces.o qm2_dftb_gettab.o qm2_dftb_load_params.o qm2_dftb_long_range.o qm2_dftb_main.o qm2_dftb_my_gradient.o qm2_dftb_my_mulliken.o qm2_dftb_repulsiv.o qm2_dftb_self.o qm2_dftb_shift.o qm2_dftb_short_range.o qm2_dftb_skpar.o qm2_dftb_slkode.o qm2_dftb_slktrafo.o \ qm_div.o force.o \ ../lmod/lmod.a ../dcqtp/src/qmmm/libdivcon.a \ ../lapack/lapack.a ../blas/blas.a \ ../lib/nxtsec.o ../lib/sys.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead pathf90 -cpp -E -P -DLES egb.f > _egb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o egb.LES.o _egb.f pathf90 -cpp -E -P -DLES nmr.f > _nmr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nmr.LES.o _nmr.f pathf90 -cpp -E -P -DLES ew_recip.f > _ew_recip.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_recip.LES.o _ew_recip.f pathf90 -cpp -E -P -DLES sander.f > _sander.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o sander.LES.o _sander.f pathf90 -cpp -E -P -DLES force.f > _force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o force.LES.o _force.f pathf90 -cpp -E -P -DLES rdparm.f > _rdparm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rdparm.LES.o _rdparm.f pathf90 -cpp -E -P -DLES mdread.f > _mdread.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mdread.LES.o _mdread.f call cnstphread(ix(icpstinf),ix(icpresst),ix(icpptcnt), & ^ pathf95-1279 pathf90: WARNING MDREAD2, File = _mdread.f, Line = 2632, Column = 25 Procedure "CNSTPHREAD" is defined at line 1094 (_mdread.f). The type of this argument does not agree with dummy argument "STATEINF". pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:43:03 pathf95: 3451 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DLES locmem.f > _locmem.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o locmem.LES.o _locmem.f pathf90 -cpp -E -P -DLES runmd.f > _runmd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o runmd.LES.o _runmd.f pathf90 -cpp -E -P -DLES degcnt.f > _degcnt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o degcnt.LES.o _degcnt.f pathf90 -cpp -E -P -DLES parallel.f > _parallel.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o parallel.LES.o _parallel.f pathf90 -cpp -E -P -DLES ene.f > _ene.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ene.LES.o _ene.f pathf90 -cpp -E -P -DLES dynlib.f > _dynlib.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o dynlib.LES.o _dynlib.f pathf90 -cpp -E -P -DLES ew_force.f > _ew_force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_force.LES.o _ew_force.f pathf90 -cpp -E -P -DLES short_ene.f > _short_ene.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o short_ene.LES.o _short_ene.f pathf90 -cpp -E -P -DLES extra_pts.f > _extra_pts.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o extra_pts.LES.o _extra_pts.f pathf90 -cpp -E -P -DPIMD pimd_vars.f > _pimd_vars.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pimd_vars.PIMD.o _pimd_vars.f pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -freeform -o sander.LES evb_vars.o evb_input.o evb_init.o evb_alloc.o evb_dealloc.o check_input.o evb_io.o evb_keywrd.o exchange_CM.o evb_mcp.o evb_force.o diabatic.o evb_2stdebug.o egap_umb_2stdebug.o exchange_gauss.o exchange_warshel.o morsify.o morse_anal2num.o evb_matrix.o evb_ntrfc.o out_evb.o constants.o qmmm_module.o trace.o lmod.o decomp.o icosasurf.o egb.LES.o findmask.o pb_force.o pb_exmol.o pb_mpfrc.o pb_direct.o pb_list.o np_force.o sa_driver.o relax_mat.o nmr.LES.o multisander.o sander.LES.o trajene.o cshf.o nmrcal.o pearsn.o printe.o runmin.o nonbond_list.o force.LES.o rdparm.LES.o mdread.LES.o locmem.LES.o runmd.LES.o getcor.o degcnt.LES.o decnvh.o fastwt.o parallel.LES.o shake.o ene.LES.o mdwrit.o minrit.o set.o dynlib.LES.o mdfil.o nmlsrc.o ew_force.LES.o ew_setup.o ew_box.o ew_bspline.o ew_fft.o short_ene.LES.o ew_recip.LES.o pcshift.o align.o stack.o rfree.o rgroup.o random.o amopen.o debug.o ew_recip_reg.o ew_handle_dips.o ew_dipole_recip.o mexit.o new_time.o extra_pts.LES.o thermo_int.o matinv.o assert.o mmtsb.o mmtsb_client.o erfcfun.o veclib.o is_init.o constantph.o prn_dipoles.o ips.o sglds.o qm_mm.o qm_link_atoms.o qm_nb_list.o qm_extract_coords.o qm_ewald.o qm_gb.o qm_zero_charges.o qm_print_info.o qm_assign_atom_types.o qm2_allocate_e_repul.o qm2_calc_charges.o qm2_calc_rij_and_eqns.o qm2_dihed.o qm2_energy.o qm2_fock.o qm2_get_qm_forces.o qm2_get_qmmm_forces.o qm2_h1elec.o qm2_hcore_qmqm.o qm2_hcore_qmmm.o qm2_identify_peptide_links.o qm2_load_params_and_allocate.o qm2_repp.o qm2_rotate_qmqm.o qm2_scf.o qm2_setup_orb_exp.o qm2_smallest_number.o qm2_dftb_module.o qm2_dftb_broyden.o qm2_dftb_dispersion_egr.o qm2_dftb_dispersion_params.o qm2_dftb_dispersionread.o qm2_dftb_eglcao.o qm2_dftb_energy.o qm2_dftb_ewevge.o qm2_dftb_externalchgrad.o qm2_dftb_externalshift.o qm2_dftb_fermi.o qm2_dftb_forces.o qm2_dftb_gamma.o qm2_dftb_gammamat.o qm2_dftb_get_qmmm_forces.o qm2_dftb_gettab.o qm2_dftb_load_params.o qm2_dftb_long_range.o qm2_dftb_main.o qm2_dftb_my_gradient.o qm2_dftb_my_mulliken.o qm2_dftb_repulsiv.o qm2_dftb_self.o qm2_dftb_shift.o qm2_dftb_short_range.o qm2_dftb_skpar.o qm2_dftb_slkode.o qm2_dftb_slktrafo.o amoeba_valence.o amoeba_multipoles.o amoeba_recip.o amoeba_interface.o amoeba_direct.o amoeba_mdin.o amoeba_adjust.o amoeba_self.o amoeba_vdw.o amoeba_induced.o amoeba_runmd.o bintraj.o spatial_recip.o spatial_fft.o pimd_vars.PIMD.o parms.o \ ../lmod/lmod.a ../lapack/lapack.a ../blas/blas.a \ ../lib/nxtsec.o ../lib/sys.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead pathf90 -cpp -E -P ambmask.f > _ambmask.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ambmask.o _ambmask.f cd ../lib; make mexit.o make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `mexit.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -freeform -o ambmask ambmask.o findmask.o \ amopen.o ../lib/mexit.o ../lib/nxtsec.o pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead pathf90 -cpp -E -P -DPIMD qmmm_module.f > _qmmm_module.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qmmm_module.PIMD.o _qmmm_module.f pathf90 -cpp -E -P -DPIMD qm_link_atoms.f > _qm_link_atoms.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_link_atoms.PIMD.o _qm_link_atoms.f pathf90 -cpp -E -P -DPIMD qm_nb_list.f > _qm_nb_list.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_nb_list.PIMD.o _qm_nb_list.f pathf90 -cpp -E -P -DPIMD qm_mm.f > _qm_mm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o qm_mm.PIMD.o _qm_mm.f pathf90 -cpp -E -P -DPIMD pimd_init.f > _pimd_init.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pimd_init.PIMD.o _pimd_init.f pathf90 -cpp -E -P -DPIMD pimd_force.f > _pimd_force.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pimd_force.PIMD.o _pimd_force.f pathf90 -cpp -E -P -DPIMD dynlib.f > _dynlib.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o dynlib.PIMD.o _dynlib.f pathf90 -cpp -E -P -DPIMD nonbond_list.f > _nonbond_list.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nonbond_list.PIMD.o _nonbond_list.f pathf90 -cpp -E -P -DPIMD ew_force.f > _ew_force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_force.PIMD.o _ew_force.f pathf90 -cpp -E -P -DPIMD egb.f > _egb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o egb.PIMD.o _egb.f pathf90 -cpp -E -P -DPIMD evb_ntrfc.f > _evb_ntrfc.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_ntrfc.PIMD.o _evb_ntrfc.f pathf90 -cpp -E -P -DPIMD evb_pimd_init.f > _evb_pimd_init.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_pimd_init.PIMD.o _evb_pimd_init.f pathf90 -cpp -E -P -DPIMD force.f > _force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o force.PIMD.o _force.f pathf90 -cpp -E -P -DPIMD mdread.f > _mdread.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mdread.PIMD.o _mdread.f call cnstphread(ix(icpstinf),ix(icpresst),ix(icpptcnt), & ^ pathf95-1279 pathf90: WARNING MDREAD2, File = _mdread.f, Line = 2636, Column = 25 Procedure "CNSTPHREAD" is defined at line 1096 (_mdread.f). The type of this argument does not agree with dummy argument "STATEINF". pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:43:22 pathf95: 3439 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P -DPIMD rdparm.f > _rdparm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rdparm.PIMD.o _rdparm.f pathf90 -cpp -E -P -DPIMD runmd.f > _runmd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o runmd.PIMD.o _runmd.f pathf90 -cpp -E -P -DPIMD sander.f > _sander.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o sander.PIMD.o _sander.f pathf90 -cpp -E -P -DPIMD short_ene.f > _short_ene.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o short_ene.PIMD.o _short_ene.f pathf90 -cpp -E -P -DPIMD ew_setup.f > _ew_setup.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ew_setup.PIMD.o _ew_setup.f pathf90 -cpp -E -P -DPIMD parallel.f > _parallel.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o parallel.PIMD.o _parallel.f pathf90 -cpp -E -P -DPIMD ene.f > _ene.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ene.PIMD.o _ene.f pathf90 -cpp -E -P -DPIMD evb_matrix.f > _evb_matrix.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o evb_matrix.PIMD.o _evb_matrix.f pathf90 -cpp -E -P -DPIMD out_evb.f > _out_evb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o out_evb.PIMD.o _out_evb.f pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -freeform -o sander.PIMD parms.o constants.o qmmm_module.PIMD.o qm_link_atoms.PIMD.o qm_nb_list.PIMD.o qm_mm.PIMD.o pimd_vars.PIMD.o pimd_init.PIMD.o pimd_force.PIMD.o dynlib.PIMD.o ew_force.PIMD.o force.PIMD.o mdread.PIMD.o nonbond_list.PIMD.o rdparm.PIMD.o runmd.PIMD.o sander.PIMD.o short_ene.PIMD.o ew_setup.PIMD.o trace.o lmod.o decomp.o icosasurf.o egb.PIMD.o findmask.o pb_force.o pb_exmol.o pb_mpfrc.o pb_direct.o pb_list.o np_force.o sa_driver.o relax_mat.o nmr.LES.o multisander.o trajene.o cshf.o nmrcal.o pearsn.o printe.o runmin.o locmem.LES.o getcor.o degcnt.LES.o decnvh.o fastwt.o parallel.PIMD.o shake.o ene.PIMD.o mdwrit.o minrit.o set.o mdfil.o nmlsrc.o ew_box.o ew_bspline.o ew_fft.o ew_recip.LES.o pcshift.o align.o stack.o rfree.o rgroup.o random.o amopen.o debug.o ew_recip_reg.o ew_handle_dips.o ew_dipole_recip.o mexit.o new_time.o extra_pts.LES.o thermo_int.o matinv.o assert.o mmtsb.o mmtsb_client.o erfcfun.o veclib.o constantph.o prn_dipoles.o ips.o sglds.o qm_zero_charges.o qm_print_info.o qm_assign_atom_types.o qm_gb.o qm_ewald.o qm_extract_coords.o qm2_allocate_e_repul.o qm2_calc_charges.o qm2_calc_rij_and_eqns.o qm2_dihed.o qm2_energy.o qm2_fock.o qm2_get_qm_forces.o qm2_get_qmmm_forces.o qm2_h1elec.o qm2_hcore_qmqm.o qm2_hcore_qmmm.o qm2_identify_peptide_links.o qm2_load_params_and_allocate.o qm2_repp.o qm2_rotate_qmqm.o qm2_scf.o qm2_setup_orb_exp.o qm2_smallest_number.o qm2_dftb_module.o qm2_dftb_broyden.o qm2_dftb_dispersion_egr.o qm2_dftb_dispersion_params.o qm2_dftb_dispersionread.o qm2_dftb_eglcao.o qm2_dftb_energy.o qm2_dftb_ewevge.o qm2_dftb_externalchgrad.o qm2_dftb_externalshift.o qm2_dftb_fermi.o qm2_dftb_forces.o qm2_dftb_gamma.o qm2_dftb_gammamat.o qm2_dftb_get_qmmm_forces.o qm2_dftb_gettab.o qm2_dftb_load_params.o qm2_dftb_long_range.o qm2_dftb_main.o qm2_dftb_my_gradient.o qm2_dftb_my_mulliken.o qm2_dftb_repulsiv.o qm2_dftb_self.o qm2_dftb_shift.o qm2_dftb_short_range.o qm2_dftb_skpar.o qm2_dftb_slkode.o qm2_dftb_slktrafo.o is_init.o amoeba_valence.o amoeba_multipoles.o amoeba_recip.o amoeba_interface.o amoeba_direct.o amoeba_mdin.o amoeba_adjust.o amoeba_self.o amoeba_vdw.o amoeba_induced.o amoeba_runmd.o bintraj.o spatial_recip.o spatial_fft.o evb_vars.o evb_input.o evb_init.o evb_alloc.o evb_dealloc.o check_input.o evb_io.o evb_keywrd.o exchange_CM.o evb_mcp.o evb_force.o diabatic.o evb_2stdebug.o egap_umb_2stdebug.o exchange_gauss.o exchange_warshel.o morsify.o morse_anal2num.o evb_matrix.PIMD.o evb_ntrfc.PIMD.o evb_pimd_init.PIMD.o out_evb.PIMD.o \ ../lmod/lmod.a ../lapack/lapack.a ../blas/blas.a \ ../lib/nxtsec.o ../lib/sys.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead /bin/mv sander sander.LES ambmask sander.PIMD ../../exe make[1]: Leaving directory `/usr/local/amber9/src/sander' cd ptraj; make install make[1]: Entering directory `/usr/local/amber9/src/ptraj' pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o main.o main.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o rdparm.o rdparm.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o dispatch.o dispatch.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o help.o help.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o utility.o utility.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o second.o second.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o io.o io.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o trajectory.o trajectory.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o evec.o evec.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o torsion.o torsion.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o mask.o mask.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o rms.o rms.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o display.o display.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o interface.o interface.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o energy.o energy.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o experimental.o experimental.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o ptraj.o ptraj.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o actions.o actions.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o analyze.o analyze.c pathf90 -cpp -E -P -DLES ../nmode/thermo.f > _thermo.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o thermo.o _thermo.f pathf90 -cpp -E -P ../sander/pubfft.f > _pubfft.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -freeform -o pubfft.o _pubfft.f if ( isign == -1) call cfftf(n1,work,table(1,1)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _pubfft.f, Line = 1106, Column = 42 Procedure "CFFTF" is defined at line 219 (_pubfft.f). The type of this argument does not agree with dummy argument "C". if ( isign == 1) call cfftb(n1,work,table(1,1)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _pubfft.f, Line = 1107, Column = 41 Procedure "CFFTB" is defined at line 135 (_pubfft.f). The type of this argument does not agree with dummy argument "C". if ( isign == -1) call cfftf(n2,work,table(1,2)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _pubfft.f, Line = 1121, Column = 42 Procedure "CFFTF" is defined at line 219 (_pubfft.f). The type of this argument does not agree with dummy argument "C". if ( isign == 1) call cfftb(n2,work,table(1,2)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _pubfft.f, Line = 1122, Column = 41 Procedure "CFFTB" is defined at line 135 (_pubfft.f). The type of this argument does not agree with dummy argument "C". if ( isign == -1) call cfftf(n3,work,table(1,3)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _pubfft.f, Line = 1136, Column = 42 Procedure "CFFTF" is defined at line 219 (_pubfft.f). The type of this argument does not agree with dummy argument "C". if ( isign == 1) call cfftb(n3,work,table(1,3)) ^ pathf95-1279 pathf90: WARNING PUBZ3D, File = _pubfft.f, Line = 1137, Column = 41 Procedure "CFFTB" is defined at line 135 (_pubfft.f). The type of this argument does not agree with dummy argument "C". pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:43:35 pathf95: 1162 source lines pathf95: 0 Error(s), 6 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message cd ../lapack; make make[2]: Entering directory `/usr/local/amber9/src/lapack' Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' ar rv lapack.a dsyev.o dsygv.o dlansy.o dsytrd.o dorgtr.o dsteqr.o dsterf.o dlascl.o dlamch.o xerbla.o ilaenv.o dlassq.o dsytd2.o dlatrd.o dorgql.o dorgqr.o dlasrt.o dlaset.o dlanst.o dlaev2.o dlasr.o dlapy2.o dlartg.o dlae2.o dorg2r.o dlarft.o dlarfb.o dorg2l.o dlarfg.o dlarf.o dspev.o dlansp.o dsptrd.o dopgtr.o dppsv.o dspsv.o dgeev.o dsptrs.o dsptrf.o dpptrs.o dpptrf.o dgebak.o dtrevc.o dlacpy.o dhseqr.o dorghr.o dgehrd.o dgebal.o dlange.o dlabad.o dlahqr.o dlarfx.o dlanhs.o dlaln2.o dgehd2.o dlahrd.o dlanv2.o dladiv.o dgerq2.o dorm2r.o dlarnv.o dgeqr2.o dlaruv.o dspevd.o dstedc.o dopmtr.o dlaed0.o dlaed1.o dlaed7.o dlaeda.o dlaed8.o dlaed9.o dlamrg.o dlaed2.o dlaed3.o dpotrf.o dsygst.o dpotf2.o dsygs2.o dlaebz.o dlagtf.o dlagts.o dormqr.o dormql.o dorm2l.o dlaed4.o dlaed5.o dlaed6.o ieeeck.o dsyevx.o dsyevd.o dstebz.o dstein.o dormtr.o zheev.o lsame.o zlanhe.o zlascl.o zhetrd.o zungtr.o zsteqr.o zlassq.o zlatrd.o zhetd2.o zungql.o zungqr.o zlasr.o zlaset.o zlacgv.o zlarfg.o zung2l.o zlarft.o zlarfb.o zung2r.o dlapy3.o zladiv.o zlarf.o r - dsyev.o r - dsygv.o r - dlansy.o r - dsytrd.o r - dorgtr.o r - dsteqr.o r - dsterf.o r - dlascl.o r - dlamch.o r - xerbla.o r - ilaenv.o r - dlassq.o r - dsytd2.o r - dlatrd.o r - dorgql.o r - dorgqr.o r - dlasrt.o r - dlaset.o r - dlanst.o r - dlaev2.o r - dlasr.o r - dlapy2.o r - dlartg.o r - dlae2.o r - dorg2r.o r - dlarft.o r - dlarfb.o r - dorg2l.o r - dlarfg.o r - dlarf.o r - dspev.o r - dlansp.o r - dsptrd.o r - dopgtr.o r - dppsv.o r - dspsv.o r - dgeev.o r - dsptrs.o r - dsptrf.o r - dpptrs.o r - dpptrf.o r - dgebak.o r - dtrevc.o r - dlacpy.o r - dhseqr.o r - dorghr.o r - dgehrd.o r - dgebal.o r - dlange.o r - dlabad.o r - dlahqr.o r - dlarfx.o r - dlanhs.o r - dlaln2.o r - dgehd2.o r - dlahrd.o r - dlanv2.o r - dladiv.o r - dgerq2.o r - dorm2r.o r - dlarnv.o r - dgeqr2.o r - dlaruv.o r - dspevd.o r - dstedc.o r - dopmtr.o r - dlaed0.o r - dlaed1.o r - dlaed7.o r - dlaeda.o r - dlaed8.o r - dlaed9.o r - dlamrg.o r - dlaed2.o r - dlaed3.o r - dpotrf.o r - dsygst.o r - dpotf2.o r - dsygs2.o r - dlaebz.o r - dlagtf.o r - dlagts.o r - dormqr.o r - dormql.o r - dorm2l.o r - dlaed4.o r - dlaed5.o r - dlaed6.o r - ieeeck.o r - dsyevx.o r - dsyevd.o r - dstebz.o r - dstein.o r - dormtr.o r - zheev.o r - lsame.o r - zlanhe.o r - zlascl.o r - zhetrd.o r - zungtr.o r - zsteqr.o r - zlassq.o r - zlatrd.o r - zhetd2.o r - zungql.o r - zungqr.o r - zlasr.o r - zlaset.o r - zlacgv.o r - zlarfg.o r - zung2l.o r - zlarft.o r - zlarfb.o r - zung2r.o r - dlapy3.o r - zladiv.o r - zlarf.o ranlib lapack.a make[2]: Leaving directory `/usr/local/amber9/src/lapack' cd ../arpack; make make[2]: Entering directory `/usr/local/amber9/src/arpack' Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' pathf90 -cpp -E -P ivout.f > _ivout.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ivout.o _ivout.f pathf90 -cpp -E -P dvout.f > _dvout.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dvout.o _dvout.f pathf90 -cpp -E -P dgetv0.f > _dgetv0.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dgetv0.o _dgetv0.f pathf90 -cpp -E -P dlaqrb.f > _dlaqrb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dlaqrb.o _dlaqrb.f pathf90 -cpp -E -P dnaitr.f > _dnaitr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dnaitr.o _dnaitr.f pathf90 -cpp -E -P dnapps.f > _dnapps.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dnapps.o _dnapps.f pathf90 -cpp -E -P dnaup2.f > _dnaup2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dnaup2.o _dnaup2.f pathf90 -cpp -E -P dnaupd.f > _dnaupd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dnaupd.o _dnaupd.f pathf90 -cpp -E -P dnconv.f > _dnconv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dnconv.o _dnconv.f pathf90 -cpp -E -P dneigh.f > _dneigh.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dneigh.o _dneigh.f pathf90 -cpp -E -P dmout.f > _dmout.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dmout.o _dmout.f pathf90 -cpp -E -P dneupd.f > _dneupd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dneupd.o _dneupd.f pathf90 -cpp -E -P dngets.f > _dngets.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dngets.o _dngets.f pathf90 -cpp -E -P dsaitr.f > _dsaitr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsaitr.o _dsaitr.f pathf90 -cpp -E -P dsapps.f > _dsapps.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsapps.o _dsapps.f pathf90 -cpp -E -P dsaup2.f > _dsaup2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsaup2.o _dsaup2.f pathf90 -cpp -E -P dsaupd.f > _dsaupd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsaupd.o _dsaupd.f pathf90 -cpp -E -P dsconv.f > _dsconv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsconv.o _dsconv.f pathf90 -cpp -E -P dseigt.f > _dseigt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dseigt.o _dseigt.f pathf90 -cpp -E -P dsesrt.f > _dsesrt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsesrt.o _dsesrt.f pathf90 -cpp -E -P dseupd.f > _dseupd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dseupd.o _dseupd.f pathf90 -cpp -E -P dsgets.f > _dsgets.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsgets.o _dsgets.f pathf90 -cpp -E -P dsortc.f > _dsortc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsortc.o _dsortc.f pathf90 -cpp -E -P dsortr.f > _dsortr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dsortr.o _dsortr.f pathf90 -cpp -E -P dstatn.f > _dstatn.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dstatn.o _dstatn.f pathf90 -cpp -E -P dstats.f > _dstats.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dstats.o _dstats.f pathf90 -cpp -E -P dstqrb.f > _dstqrb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dstqrb.o _dstqrb.f pathf90 -cpp -E -P svout.f > _svout.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o svout.o _svout.f pathf90 -cpp -E -P sgetv0.f > _sgetv0.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sgetv0.o _sgetv0.f pathf90 -cpp -E -P slaqrb.f > _slaqrb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o slaqrb.o _slaqrb.f pathf90 -cpp -E -P snaitr.f > _snaitr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o snaitr.o _snaitr.f pathf90 -cpp -E -P snapps.f > _snapps.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o snapps.o _snapps.f pathf90 -cpp -E -P snaup2.f > _snaup2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o snaup2.o _snaup2.f pathf90 -cpp -E -P snaupd.f > _snaupd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o snaupd.o _snaupd.f pathf90 -cpp -E -P snconv.f > _snconv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o snconv.o _snconv.f pathf90 -cpp -E -P sneigh.f > _sneigh.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sneigh.o _sneigh.f pathf90 -cpp -E -P smout.f > _smout.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o smout.o _smout.f pathf90 -cpp -E -P sneupd.f > _sneupd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sneupd.o _sneupd.f pathf90 -cpp -E -P sngets.f > _sngets.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sngets.o _sngets.f pathf90 -cpp -E -P ssaitr.f > _ssaitr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssaitr.o _ssaitr.f pathf90 -cpp -E -P ssapps.f > _ssapps.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssapps.o _ssapps.f pathf90 -cpp -E -P ssaup2.f > _ssaup2.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssaup2.o _ssaup2.f pathf90 -cpp -E -P ssaupd.f > _ssaupd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssaupd.o _ssaupd.f pathf90 -cpp -E -P ssconv.f > _ssconv.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssconv.o _ssconv.f pathf90 -cpp -E -P sseigt.f > _sseigt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sseigt.o _sseigt.f pathf90 -cpp -E -P ssesrt.f > _ssesrt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssesrt.o _ssesrt.f pathf90 -cpp -E -P sseupd.f > _sseupd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sseupd.o _sseupd.f pathf90 -cpp -E -P ssgets.f > _ssgets.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssgets.o _ssgets.f pathf90 -cpp -E -P ssortc.f > _ssortc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssortc.o _ssortc.f pathf90 -cpp -E -P ssortr.f > _ssortr.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ssortr.o _ssortr.f pathf90 -cpp -E -P sstatn.f > _sstatn.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sstatn.o _sstatn.f pathf90 -cpp -E -P sstats.f > _sstats.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sstats.o _sstats.f pathf90 -cpp -E -P sstqrb.f > _sstqrb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sstqrb.o _sstqrb.f ar rv arpack.a ivout.o dvout.o dgetv0.o dlaqrb.o dnaitr.o dnapps.o dnaup2.o dnaupd.o dnconv.o dneigh.o dmout.o dneupd.o dngets.o dsaitr.o dsapps.o dsaup2.o dsaupd.o dsconv.o dseigt.o dsesrt.o dseupd.o dsgets.o dsortc.o dsortr.o dstatn.o dstats.o dstqrb.o svout.o sgetv0.o slaqrb.o snaitr.o snapps.o snaup2.o snaupd.o snconv.o sneigh.o smout.o sneupd.o sngets.o ssaitr.o ssapps.o ssaup2.o ssaupd.o ssconv.o sseigt.o ssesrt.o sseupd.o ssgets.o ssortc.o ssortr.o sstatn.o sstats.o sstqrb.o ar: creating arpack.a a - ivout.o a - dvout.o a - dgetv0.o a - dlaqrb.o a - dnaitr.o a - dnapps.o a - dnaup2.o a - dnaupd.o a - dnconv.o a - dneigh.o a - dmout.o a - dneupd.o a - dngets.o a - dsaitr.o a - dsapps.o a - dsaup2.o a - dsaupd.o a - dsconv.o a - dseigt.o a - dsesrt.o a - dseupd.o a - dsgets.o a - dsortc.o a - dsortr.o a - dstatn.o a - dstats.o a - dstqrb.o a - svout.o a - sgetv0.o a - slaqrb.o a - snaitr.o a - snapps.o a - snaup2.o a - snaupd.o a - snconv.o a - sneigh.o a - smout.o a - sneupd.o a - sngets.o a - ssaitr.o a - ssapps.o a - ssaup2.o a - ssaupd.o a - ssconv.o a - sseigt.o a - ssesrt.o a - sseupd.o a - ssgets.o a - ssortc.o a - ssortr.o a - sstatn.o a - sstats.o a - sstqrb.o ranlib arpack.a make[2]: Leaving directory `/usr/local/amber9/src/arpack' cd ../blas; make make[2]: Entering directory `/usr/local/amber9/src/blas' Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' ar rv blas.a dasum.o daxpy.o dcabs1.o dcopy.o ddot.o dgbmv.o dgemm.o dgemv.o dger.o dnrm2.o drot.o drotg.o dsbmv.o dscal.o dspmv.o dspr.o dspr2.o dswap.o dsymm.o dsymv.o dsyr.o dsyr2.o dsyr2k.o dsyrk.o dtbmv.o dtbsv.o dtpmv.o dtpsv.o dtrmm.o dtrmv.o dtrsm.o dtrsv.o dummy.o dzasum.o dznrm2.o idamax.o isamax.o lsame.o scopy.o sswap.o sscal.o sasum.o snrm2.o sdot.o ssyr2k.o saxpy.o sgemv.o ssyr2.o ssymv.o sgemm.o strmm.o strmv.o sger.o zher2k.o zswap.o zgemv.o zhemv.o zscal.o zdotc.o zaxpy.o zher2.o zdscal.o ztrmv.o zcopy.o ztrmm.o zgemm.o zgerc.o r - dasum.o r - daxpy.o r - dcabs1.o r - dcopy.o r - ddot.o r - dgbmv.o r - dgemm.o r - dgemv.o r - dger.o r - dnrm2.o r - drot.o r - drotg.o r - dsbmv.o r - dscal.o r - dspmv.o r - dspr.o r - dspr2.o r - dswap.o r - dsymm.o r - dsymv.o r - dsyr.o r - dsyr2.o r - dsyr2k.o r - dsyrk.o r - dtbmv.o r - dtbsv.o r - dtpmv.o r - dtpsv.o r - dtrmm.o r - dtrmv.o r - dtrsm.o r - dtrsv.o r - dummy.o r - dzasum.o r - dznrm2.o r - idamax.o r - isamax.o r - lsame.o r - scopy.o r - sswap.o r - sscal.o r - sasum.o r - snrm2.o r - sdot.o r - ssyr2k.o r - saxpy.o r - sgemv.o r - ssyr2.o r - ssymv.o r - sgemm.o r - strmm.o r - strmv.o r - sger.o r - zher2k.o r - zswap.o r - zgemv.o r - zhemv.o r - zscal.o r - zdotc.o r - zaxpy.o r - zher2.o r - zdscal.o r - ztrmv.o r - zcopy.o r - ztrmm.o r - zgemm.o r - zgerc.o ranlib blas.a make[2]: Leaving directory `/usr/local/amber9/src/blas' cd ../lib ; make sys.a make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `sys.a' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' cd pdb; make make[2]: Entering directory `/usr/local/amber9/src/ptraj/pdb' pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o pdbrun.o pdbrun.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o pdb_read.o pdb_read.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o pdb_sprntf.o pdb_sprntf.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o pdb_sscanf.o pdb_sscanf.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o pdb_write.o pdb_write.c pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o ms.o ms.c ar rv libpdb.a pdbrun.o pdb_read.o pdb_sprntf.o pdb_sscanf.o pdb_write.o ms.o ar: creating libpdb.a a - pdbrun.o a - pdb_read.o a - pdb_sprntf.o a - pdb_sscanf.o a - pdb_write.o a - ms.o ranlib libpdb.a make[2]: Leaving directory `/usr/local/amber9/src/ptraj/pdb' pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -freeform -o rdparm main.o rdparm.o dispatch.o help.o utility.o second.o io.o trajectory.o evec.o torsion.o mask.o rms.o display.o interface.o energy.o experimental.o ptraj.o actions.o analyze.o thermo.o pubfft.o pdb/libpdb.a ../arpack/arpack.a ../lapack/lapack.a ../blas/blas.a ../lib/sys.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -freeform -o ptraj main.o rdparm.o dispatch.o help.o utility.o second.o io.o trajectory.o evec.o torsion.o mask.o rms.o display.o interface.o energy.o experimental.o ptraj.o actions.o analyze.o thermo.o pubfft.o pdb/libpdb.a ../arpack/arpack.a ../lapack/lapack.a ../blas/blas.a ../lib/sys.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead /bin/mv rdparm ptraj ../../exe make[1]: Leaving directory `/usr/local/amber9/src/ptraj' cd nmr_aux; make install make[1]: Entering directory `/usr/local/amber9/src/nmr_aux' cd prepare_input; make clean ; make install make[2]: Entering directory `/usr/local/amber9/src/nmr_aux/prepare_input' /bin/rm *.o _*.f makeDIST_RST makeANG_RST makeSHF.cp makeCHIR_RST.cp \ makeDIP_RST.protein.cp makeDIP_RST.dna.cp /bin/rm: cannot remove `*.o': No such file or directory /bin/rm: cannot remove `_*.f': No such file or directory /bin/rm: cannot remove `makeDIST_RST': No such file or directory /bin/rm: cannot remove `makeANG_RST': No such file or directory /bin/rm: cannot remove `makeSHF.cp': No such file or directory /bin/rm: cannot remove `makeCHIR_RST.cp': No such file or directory /bin/rm: cannot remove `makeDIP_RST.protein.cp': No such file or directory /bin/rm: cannot remove `makeDIP_RST.dna.cp': No such file or directory make[2]: [clean] Error 1 (ignored) make[2]: Leaving directory `/usr/local/amber9/src/nmr_aux/prepare_input' make[2]: Entering directory `/usr/local/amber9/src/nmr_aux/prepare_input' pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o makeDIST_RST.o makeDIST_RST.c pathcc -static -o makeDIST_RST makeDIST_RST.o -lm pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o makeANG_RST.o makeANG_RST.c pathcc -static -o makeANG_RST makeANG_RST.o -lm /bin/rm -f makeSHF_RST.cp makeCHIR_RST.cp makeDIP_RST.protein.cp \ makeDIP_RST.dna.cp cp makeSHF_RST makeSHF_RST.cp cp makeCHIR_RST makeCHIR_RST.cp cp makeDIP_RST.protein makeDIP_RST.protein.cp cp makeDIP_RST.dna makeDIP_RST.dna.cp chmod 755 makeDIST_RST makeANG_RST makeSHF_RST.cp makeCHIR_RST.cp \ makeDIP_RST.protein.cp makeDIP_RST.dna.cp mv makeDIST_RST makeANG_RST ../../../exe mv makeCHIR_RST.cp ../../../exe/makeCHIR_RST mv makeSHF_RST.cp ../../../exe/makeSHF_RST mv makeDIP_RST.protein.cp ../../../exe/makeDIP_RST.protein mv makeDIP_RST.dna.cp ../../../exe/makeDIP_RST.dna cp map.DG-AMBER ../../../dat cp map.Brook-AMBER ../../../dat make[2]: Leaving directory `/usr/local/amber9/src/nmr_aux/prepare_input' cd fantasian; make clean ; make install make[2]: Entering directory `/usr/local/amber9/src/nmr_aux/fantasian' /bin/rm *.o _*.f fantasian /bin/rm: cannot remove `*.o': No such file or directory /bin/rm: cannot remove `_*.f': No such file or directory /bin/rm: cannot remove `fantasian': No such file or directory make[2]: [clean] Error 1 (ignored) make[2]: Leaving directory `/usr/local/amber9/src/nmr_aux/fantasian' make[2]: Entering directory `/usr/local/amber9/src/nmr_aux/fantasian' pathf90 -cpp -E -P fantasian.f > _fantasian.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o fantasian.o _fantasian.f pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o fantasian fantasian.o ../../lib/random.o ../../lib/mexit.o pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead mv fantasian ../../../exe/ make[2]: Leaving directory `/usr/local/amber9/src/nmr_aux/fantasian' cp senergy sviol sviol2 ../../exe make[1]: Leaving directory `/usr/local/amber9/src/nmr_aux' cd nmode; make install make[1]: Entering directory `/usr/local/amber9/src/nmode' pathf90 -cpp -E -P nmode.f > _nmode.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nmode.o _nmode.f pathf90 -cpp -E -P alloc.f > _alloc.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o alloc.o _alloc.f pathf90 -cpp -E -P angl.f > _angl.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o angl.o _angl.f pathf90 -cpp -E -P assert.f > _assert.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o assert.o _assert.f pathf90 -cpp -E -P bond.f > _bond.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o bond.o _bond.f pathf90 -cpp -E -P bresna.f > _bresna.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o bresna.o _bresna.f pathf90 -cpp -E -P cdiv.f > _cdiv.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o cdiv.o _cdiv.f pathf90 -cpp -E -P chck.f > _chck.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o chck.o _chck.f pathf90 -cpp -E -P chdir.f > _chdir.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o chdir.o _chdir.f pathf90 -cpp -E -P chlamba.f > _chlamba.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o chlamba.o _chlamba.f pathf90 -cpp -E -P debug.f > _debug.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o debug.o _debug.f pathf90 -cpp -E -P difang.f > _difang.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o difang.o _difang.f pathf90 -cpp -E -P difbon.f > _difbon.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o difbon.o _difbon.f pathf90 -cpp -E -P dihdup.f > _dihdup.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o dihdup.o _dihdup.f pathf90 -cpp -E -P dihed.f > _dihed.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o dihed.o _dihed.f pathf90 -cpp -E -P dirch.f > _dirch.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o dirch.o _dirch.f pathf90 -cpp -E -P dsort.f > _dsort.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o dsort.o _dsort.f pathf90 -cpp -E -P eigout.f > _eigout.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o eigout.o _eigout.f pathf90 -cpp -E -P ephi.f > _ephi.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ephi.o _ephi.f pathf90 -cpp -E -P eprnt.f > _eprnt.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o eprnt.o _eprnt.f pathf90 -cpp -E -P errstp.f > _errstp.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o errstp.o _errstp.f pathf90 -cpp -E -P findl.f > _findl.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o findl.o _findl.f pathf90 -cpp -E -P forces.f > _forces.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o forces.o _forces.f pathf90 -cpp -E -P getcor.f > _getcor.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o getcor.o _getcor.f pathf90 -cpp -E -P getf.f > _getf.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o getf.o _getf.f pathf90 -cpp -E -P getm.f > _getm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o getm.o _getm.f pathf90 -cpp -E -P getref.f > _getref.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o getref.o _getref.f pathf90 -cpp -E -P grdmax.f > _grdmax.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o grdmax.o _grdmax.f pathf90 -cpp -E -P level.f > _level.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o level.o _level.f pathf90 -cpp -E -P lmdout.f > _lmdout.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o lmdout.o _lmdout.f pathf90 -cpp -E -P lmode.f > _lmode.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o lmode.o _lmode.f pathf90 -cpp -E -P makel.f > _makel.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o makel.o _makel.f pathf90 -cpp -E -P movecm.f > _movecm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o movecm.o _movecm.f pathf90 -cpp -E -P mweight.f > _mweight.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mweight.o _mweight.f pathf90 -cpp -E -P mweit.f > _mweit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mweit.o _mweit.f pathf90 -cpp -E -P new_stuff.f > _new_stuff.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o new_stuff.o _new_stuff.f pathf90 -cpp -E -P nmdfil.f > _nmdfil.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nmdfil.o _nmdfil.f pathf90 -cpp -E -P nonbon.f > _nonbon.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nonbon.o _nonbon.f pathf90 -cpp -E -P nonbon1.f > _nonbon1.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nonbon1.o _nonbon1.f pathf90 -cpp -E -P norm.f > _norm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o norm.o _norm.f pathf90 -cpp -E -P norml.f > _norml.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o norml.o _norml.f pathf90 -cpp -E -P nrch.f > _nrch.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nrch.o _nrch.f pathf90 -cpp -E -P oseen.f > _oseen.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o oseen.o _oseen.f pathf90 -cpp -E -P pairr.f > _pairr.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pairr.o _pairr.f pathf90 -cpp -E -P pairw.f > _pairw.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pairw.o _pairw.f pathf90 -cpp -E -P percon.f > _percon.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o percon.o _percon.f pathf90 -cpp -E -P pload.f > _pload.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pload.o _pload.f pathf90 -cpp -E -P putvar.f > _putvar.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o putvar.o _putvar.f pathf90 -cpp -E -P rdinp.f > _rdinp.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rdinp.o _rdinp.f pathf90 -cpp -E -P rdparm.f > _rdparm.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rdparm.o _rdparm.f pathf90 -cpp -E -P remrot.f > _remrot.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o remrot.o _remrot.f pathf90 -cpp -E -P resdis.f > _resdis.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o resdis.o _resdis.f pathf90 -cpp -E -P savec.f > _savec.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o savec.o _savec.f pathf90 -cpp -E -P savei.f > _savei.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o savei.o _savei.f pathf90 -cpp -E -P savet.f > _savet.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o savet.o _savet.f pathf90 -cpp -E -P setang.f > _setang.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o setang.o _setang.f pathf90 -cpp -E -P setatm.f > _setatm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o setatm.o _setatm.f pathf90 -cpp -E -P setbon.f > _setbon.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o setbon.o _setbon.f pathf90 -cpp -E -P setcor.f > _setcor.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o setcor.o _setcor.f pathf90 -cpp -E -P setdih.f > _setdih.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o setdih.o _setdih.f pathf90 -cpp -E -P setgam.f > _setgam.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o setgam.o _setgam.f pathf90 -cpp -E -P setgr.f > _setgr.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o setgr.o _setgr.f pathf90 -cpp -E -P setvar.f > _setvar.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o setvar.o _setvar.f pathf90 -cpp -E -P spsort.f > _spsort.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o spsort.o _spsort.f pathf90 -cpp -E -P thermo.f > _thermo.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o thermo.o _thermo.f pathf90 -cpp -E -P timit.f > _timit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o timit.o _timit.f pathf90 -cpp -E -P traco.f > _traco.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o traco.o _traco.f pathf90 -cpp -E -P tsearch.f > _tsearch.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o tsearch.o _tsearch.f pathf90 -cpp -E -P tstate.f > _tstate.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o tstate.o _tstate.f pathf90 -cpp -E -P xconst.f > _xconst.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o xconst.o _xconst.f pathf90 -cpp -E -P zerout.f > _zerout.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o zerout.o _zerout.f pathf90 -cpp -E -P zxcgr.f > _zxcgr.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o zxcgr.o _zxcgr.f pathf90 -cpp -E -P mexit.f > _mexit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mexit.o _mexit.f cd ../lib ; ./Makelist ../lib/rfree.o ../lib/matinv.o ../lib/nxtsec.o ../lib/amopen.o ../lib/rgroup.o make[2]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P rfree.f > _rfree.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o rfree.o _rfree.f make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P matinv.f > _matinv.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o matinv.o _matinv.f make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `nxtsec.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P amopen.f > _amopen.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o amopen.o _amopen.f make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P rgroup.f > _rgroup.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o rgroup.o _rgroup.f make[2]: Leaving directory `/usr/local/amber9/src/lib' cd ../lib; make sys.a make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `sys.a' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' cd ../lapack; make make[2]: Entering directory `/usr/local/amber9/src/lapack' Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' ar rv lapack.a dsyev.o dsygv.o dlansy.o dsytrd.o dorgtr.o dsteqr.o dsterf.o dlascl.o dlamch.o xerbla.o ilaenv.o dlassq.o dsytd2.o dlatrd.o dorgql.o dorgqr.o dlasrt.o dlaset.o dlanst.o dlaev2.o dlasr.o dlapy2.o dlartg.o dlae2.o dorg2r.o dlarft.o dlarfb.o dorg2l.o dlarfg.o dlarf.o dspev.o dlansp.o dsptrd.o dopgtr.o dppsv.o dspsv.o dgeev.o dsptrs.o dsptrf.o dpptrs.o dpptrf.o dgebak.o dtrevc.o dlacpy.o dhseqr.o dorghr.o dgehrd.o dgebal.o dlange.o dlabad.o dlahqr.o dlarfx.o dlanhs.o dlaln2.o dgehd2.o dlahrd.o dlanv2.o dladiv.o dgerq2.o dorm2r.o dlarnv.o dgeqr2.o dlaruv.o dspevd.o dstedc.o dopmtr.o dlaed0.o dlaed1.o dlaed7.o dlaeda.o dlaed8.o dlaed9.o dlamrg.o dlaed2.o dlaed3.o dpotrf.o dsygst.o dpotf2.o dsygs2.o dlaebz.o dlagtf.o dlagts.o dormqr.o dormql.o dorm2l.o dlaed4.o dlaed5.o dlaed6.o ieeeck.o dsyevx.o dsyevd.o dstebz.o dstein.o dormtr.o zheev.o lsame.o zlanhe.o zlascl.o zhetrd.o zungtr.o zsteqr.o zlassq.o zlatrd.o zhetd2.o zungql.o zungqr.o zlasr.o zlaset.o zlacgv.o zlarfg.o zung2l.o zlarft.o zlarfb.o zung2r.o dlapy3.o zladiv.o zlarf.o r - dsyev.o r - dsygv.o r - dlansy.o r - dsytrd.o r - dorgtr.o r - dsteqr.o r - dsterf.o r - dlascl.o r - dlamch.o r - xerbla.o r - ilaenv.o r - dlassq.o r - dsytd2.o r - dlatrd.o r - dorgql.o r - dorgqr.o r - dlasrt.o r - dlaset.o r - dlanst.o r - dlaev2.o r - dlasr.o r - dlapy2.o r - dlartg.o r - dlae2.o r - dorg2r.o r - dlarft.o r - dlarfb.o r - dorg2l.o r - dlarfg.o r - dlarf.o r - dspev.o r - dlansp.o r - dsptrd.o r - dopgtr.o r - dppsv.o r - dspsv.o r - dgeev.o r - dsptrs.o r - dsptrf.o r - dpptrs.o r - dpptrf.o r - dgebak.o r - dtrevc.o r - dlacpy.o r - dhseqr.o r - dorghr.o r - dgehrd.o r - dgebal.o r - dlange.o r - dlabad.o r - dlahqr.o r - dlarfx.o r - dlanhs.o r - dlaln2.o r - dgehd2.o r - dlahrd.o r - dlanv2.o r - dladiv.o r - dgerq2.o r - dorm2r.o r - dlarnv.o r - dgeqr2.o r - dlaruv.o r - dspevd.o r - dstedc.o r - dopmtr.o r - dlaed0.o r - dlaed1.o r - dlaed7.o r - dlaeda.o r - dlaed8.o r - dlaed9.o r - dlamrg.o r - dlaed2.o r - dlaed3.o r - dpotrf.o r - dsygst.o r - dpotf2.o r - dsygs2.o r - dlaebz.o r - dlagtf.o r - dlagts.o r - dormqr.o r - dormql.o r - dorm2l.o r - dlaed4.o r - dlaed5.o r - dlaed6.o r - ieeeck.o r - dsyevx.o r - dsyevd.o r - dstebz.o r - dstein.o r - dormtr.o r - zheev.o r - lsame.o r - zlanhe.o r - zlascl.o r - zhetrd.o r - zungtr.o r - zsteqr.o r - zlassq.o r - zlatrd.o r - zhetd2.o r - zungql.o r - zungqr.o r - zlasr.o r - zlaset.o r - zlacgv.o r - zlarfg.o r - zung2l.o r - zlarft.o r - zlarfb.o r - zung2r.o r - dlapy3.o r - zladiv.o r - zlarf.o ranlib lapack.a make[2]: Leaving directory `/usr/local/amber9/src/lapack' cd ../blas; make make[2]: Entering directory `/usr/local/amber9/src/blas' Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' ar rv blas.a dasum.o daxpy.o dcabs1.o dcopy.o ddot.o dgbmv.o dgemm.o dgemv.o dger.o dnrm2.o drot.o drotg.o dsbmv.o dscal.o dspmv.o dspr.o dspr2.o dswap.o dsymm.o dsymv.o dsyr.o dsyr2.o dsyr2k.o dsyrk.o dtbmv.o dtbsv.o dtpmv.o dtpsv.o dtrmm.o dtrmv.o dtrsm.o dtrsv.o dummy.o dzasum.o dznrm2.o idamax.o isamax.o lsame.o scopy.o sswap.o sscal.o sasum.o snrm2.o sdot.o ssyr2k.o saxpy.o sgemv.o ssyr2.o ssymv.o sgemm.o strmm.o strmv.o sger.o zher2k.o zswap.o zgemv.o zhemv.o zscal.o zdotc.o zaxpy.o zher2.o zdscal.o ztrmv.o zcopy.o ztrmm.o zgemm.o zgerc.o r - dasum.o r - daxpy.o r - dcabs1.o r - dcopy.o r - ddot.o r - dgbmv.o r - dgemm.o r - dgemv.o r - dger.o r - dnrm2.o r - drot.o r - drotg.o r - dsbmv.o r - dscal.o r - dspmv.o r - dspr.o r - dspr2.o r - dswap.o r - dsymm.o r - dsymv.o r - dsyr.o r - dsyr2.o r - dsyr2k.o r - dsyrk.o r - dtbmv.o r - dtbsv.o r - dtpmv.o r - dtpsv.o r - dtrmm.o r - dtrmv.o r - dtrsm.o r - dtrsv.o r - dummy.o r - dzasum.o r - dznrm2.o r - idamax.o r - isamax.o r - lsame.o r - scopy.o r - sswap.o r - sscal.o r - sasum.o r - snrm2.o r - sdot.o r - ssyr2k.o r - saxpy.o r - sgemv.o r - ssyr2.o r - ssymv.o r - sgemm.o r - strmm.o r - strmv.o r - sger.o r - zher2k.o r - zswap.o r - zgemv.o r - zhemv.o r - zscal.o r - zdotc.o r - zaxpy.o r - zher2.o r - zdscal.o r - ztrmv.o r - zcopy.o r - ztrmm.o r - zgemm.o r - zgerc.o ranlib blas.a make[2]: Leaving directory `/usr/local/amber9/src/blas' pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -freeform -o nmode nmode.o alloc.o angl.o assert.o bond.o bresna.o cdiv.o chck.o chdir.o chlamba.o debug.o difang.o difbon.o dihdup.o dihed.o dirch.o dsort.o eigout.o ephi.o eprnt.o errstp.o findl.o forces.o getcor.o getf.o getm.o getref.o grdmax.o level.o lmdout.o lmode.o makel.o movecm.o mweight.o mweit.o new_stuff.o nmdfil.o nonbon.o nonbon1.o norm.o norml.o nrch.o oseen.o pairr.o pairw.o percon.o pload.o putvar.o rdinp.o rdparm.o remrot.o resdis.o savec.o savei.o savet.o setang.o setatm.o setbon.o setcor.o setdih.o setgam.o setgr.o setvar.o spsort.o thermo.o timit.o traco.o tsearch.o tstate.o xconst.o zerout.o zxcgr.o mexit.o ../lib/rfree.o ../lib/matinv.o ../lib/nxtsec.o ../lib/amopen.o ../lib/rgroup.o \ ../lib/sys.a ../lapack/lapack.a ../blas/blas.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead /bin/mv nmode ../../exe make[1]: Leaving directory `/usr/local/amber9/src/nmode' cd resp; make install make[1]: Entering directory `/usr/local/amber9/src/resp' pathf90 -cpp -E -P resp.f > _resp.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o resp.o _resp.f cd ../lib ; ./Makelist ../lib/mexit.o ../lib/amopen.o ../lib/lapack.o make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `mexit.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `amopen.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P lapack.f > _lapack.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o lapack.o _lapack.f make[2]: Leaving directory `/usr/local/amber9/src/lib' cd ../lib ; make sys.a make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `sys.a' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o resp resp.o ../lib/mexit.o ../lib/amopen.o ../lib/lapack.o ../lib/sys.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead /bin/mv resp ../../exe/ make[1]: Leaving directory `/usr/local/amber9/src/resp' cd protonate; make install make[1]: Entering directory `/usr/local/amber9/src/protonate' pathf90 -cpp -E -P pol_h.f > _pol_h.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o pol_h.o _pol_h.f pathf90 -cpp -E -P stm_sel.f > _stm_sel.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o stm_sel.o _stm_sel.f pathf90 -cpp -E -P sortf_as.f > _sortf_as.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sortf_as.o _sortf_as.f cd ../lib ; ./Makelist ../lib/mexit.o ../lib/amopen.o make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `mexit.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `amopen.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' cd ../lib; make sys.a make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `sys.a' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o pol_h pol_h.o stm_sel.o sortf_as.o ../lib/mexit.o ../lib/amopen.o ../lib/sys.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead pathf90 -cpp -E -P protonate.f > _protonate.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o protonate.o _protonate.f call unit(1,2,r1,ierror) ^ pathf95-1675 pathf90: WARNING HYDROS, File = _protonate.f, Line = 922, Column = 12 Intrinsic "UNIT" is a function, so this call to a subroutine will be treated as "external" pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:43:55 pathf95: 1703 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o protonate protonate.o ../lib/mexit.o ../lib/amopen.o ../lib/sys.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead pathf90 -cpp -E -P gwh.f > _gwh.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o gwh.o _gwh.f pathf90 -cpp -E -P pdbatm.f > _pdbatm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o pdbatm.o _pdbatm.f pathf90 -cpp -E -P pdbhet2.f > _pdbhet2.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o pdbhet2.o _pdbhet2.f pathf90 -cpp -E -P top_3.f > _top_3.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o top_3.o _top_3.f pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o gwh gwh.o pdbatm.o pdbhet2.o top_3.o stm_sel.o sortf_as.o ../lib/mexit.o ../lib/amopen.o ../lib/sys.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead mv pol_h protonate gwh ../../exe/ make[1]: Leaving directory `/usr/local/amber9/src/protonate' cd anal; make install make[1]: Entering directory `/usr/local/amber9/src/anal' pathf90 -cpp -E -P anafil.f > _anafil.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o anafil.o _anafil.f pathf90 -cpp -E -P analgr.f > _analgr.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o analgr.o _analgr.f pathf90 -cpp -E -P analys.f > _analys.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o analys.o _analys.f pathf90 -cpp -E -P angl.f > _angl.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o angl.o _angl.f pathf90 -cpp -E -P anglp.f > _anglp.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o anglp.o _anglp.f pathf90 -cpp -E -P bangle.f > _bangle.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o bangle.o _bangle.f pathf90 -cpp -E -P bond.f > _bond.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o bond.o _bond.f pathf90 -cpp -E -P calhb.f > _calhb.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o calhb.o _calhb.f pathf90 -cpp -E -P chain.f > _chain.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o chain.o _chain.f pathf90 -cpp -E -P clear.f > _clear.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o clear.o _clear.f pathf90 -cpp -E -P compact.f > _compact.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o compact.o _compact.f pathf90 -cpp -E -P dist.f > _dist.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o dist.o _dist.f pathf90 -cpp -E -P egout.f > _egout.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o egout.o _egout.f pathf90 -cpp -E -P ephi.f > _ephi.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ephi.o _ephi.f pathf90 -cpp -E -P gaus80.f > _gaus80.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o gaus80.o _gaus80.f pathf90 -cpp -E -P gauss.f > _gauss.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o gauss.o _gauss.f pathf90 -cpp -E -P getall.f > _getall.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o getall.o _getall.f pathf90 -cpp -E -P getcmn.f > _getcmn.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o getcmn.o _getcmn.f pathf90 -cpp -E -P hangl.f > _hangl.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o hangl.o _hangl.f pathf90 -cpp -E -P haxis.f > _haxis.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o haxis.o _haxis.f pathf90 -cpp -E -P hbond.f > _hbond.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o hbond.o _hbond.f pathf90 -cpp -E -P hbout.f > _hbout.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o hbout.o _hbout.f pathf90 -cpp -E -P locmem.f > _locmem.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o locmem.o _locmem.f pathf90 -cpp -E -P lsqstr.f > _lsqstr.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o lsqstr.o _lsqstr.f pathf90 -cpp -E -P matind.f > _matind.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o matind.o _matind.f pathf90 -cpp -E -P mdbox.f > _mdbox.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o mdbox.o _mdbox.f pathf90 -cpp -E -P mdread.f > _mdread.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o mdread.o _mdread.f pathf90 -cpp -E -P minv.f > _minv.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o minv.o _minv.f pathf90 -cpp -E -P movecm.f > _movecm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o movecm.o _movecm.f pathf90 -cpp -E -P nhbpar.f > _nhbpar.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o nhbpar.o _nhbpar.f pathf90 -cpp -E -P pdbout.f > _pdbout.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o pdbout.o _pdbout.f pathf90 -cpp -E -P pdbrit.f > _pdbrit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o pdbrit.o _pdbrit.f pathf90 -cpp -E -P percon.f > _percon.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o percon.o _percon.f pathf90 -cpp -E -P prtri.f > _prtri.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o prtri.o _prtri.f pathf90 -cpp -E -P prtrin.f > _prtrin.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o prtrin.o _prtrin.f pathf90 -cpp -E -P puck.f > _puck.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o puck.o _puck.f pathf90 -cpp -E -P radgy.f > _radgy.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o radgy.o _radgy.f pathf90 -cpp -E -P rdparm.f > _rdparm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o rdparm.o _rdparm.f pathf90 -cpp -E -P rdrest.f > _rdrest.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o rdrest.o _rdrest.f pathf90 -cpp -E -P resdis.f > _resdis.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o resdis.o _resdis.f pathf90 -cpp -E -P resnbn.f > _resnbn.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o resnbn.o _resnbn.f pathf90 -cpp -E -P resnbp.f > _resnbp.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o resnbp.o _resnbp.f pathf90 -cpp -E -P rms.f > _rms.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o rms.o _rms.f pathf90 -cpp -E -P rmsfit.f > _rmsfit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o rmsfit.o _rmsfit.f pathf90 -cpp -E -P rmsmov.f > _rmsmov.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o rmsmov.o _rmsmov.f pathf90 -cpp -E -P stell.f > _stell.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o stell.o _stell.f pathf90 -cpp -E -P stogrd.f > _stogrd.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o stogrd.o _stogrd.f pathf90 -cpp -E -P sumgrp.f > _sumgrp.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o sumgrp.o _sumgrp.f pathf90 -cpp -E -P tell.f > _tell.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o tell.o _tell.f pathf90 -cpp -E -P tilang.f > _tilang.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o tilang.o _tilang.f pathf90 -cpp -E -P tilt.f > _tilt.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o tilt.o _tilt.f pathf90 -cpp -E -P tors.f > _tors.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o tors.o _tors.f pathf90 -cpp -E -P traco.f > _traco.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o traco.o _traco.f pathf90 -cpp -E -P vect.f > _vect.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o vect.o _vect.f pathf90 -cpp -E -P volume.f > _volume.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o volume.o _volume.f pathf90 -cpp -E -P xconst.f > _xconst.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o xconst.o _xconst.f cd ../lib ; ./Makelist ../lib/rfree.o ../lib/rgroup.o ../lib/nxtsec.o ../lib/util.o ../lib/amopen.o ../lib/mexit.o ../lib/ligenb.o make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `rfree.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `rgroup.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `nxtsec.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P util.f > _util.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o util.o _util.f make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `amopen.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `mexit.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' pathf90 -cpp -E -P ligenb.f > _ligenb.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ligenb.o _ligenb.f make[2]: Leaving directory `/usr/local/amber9/src/lib' cd ../lib; make sys.a make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `sys.a' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o anal anafil.o analgr.o analys.o angl.o anglp.o bangle.o bond.o calhb.o chain.o clear.o compact.o dist.o egout.o ephi.o gaus80.o gauss.o getall.o getcmn.o hangl.o haxis.o hbond.o hbout.o locmem.o lsqstr.o matind.o mdbox.o mdread.o minv.o movecm.o nhbpar.o pdbout.o pdbrit.o percon.o prtri.o prtrin.o puck.o radgy.o rdparm.o rdrest.o resdis.o resnbn.o resnbp.o rms.o rmsfit.o rmsmov.o stell.o stogrd.o sumgrp.o tell.o tilang.o tilt.o tors.o traco.o vect.o volume.o xconst.o ../lib/rfree.o ../lib/rgroup.o ../lib/nxtsec.o ../lib/util.o ../lib/amopen.o ../lib/mexit.o ../lib/ligenb.o ../lib/sys.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead /bin/mv anal ../../exe/ make[1]: Leaving directory `/usr/local/amber9/src/anal' cd mm_pbsa; make install make[1]: Entering directory `/usr/local/amber9/src/mm_pbsa' pathf90 -cpp -E -P make_crd_hg.f > _make_crd_hg.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o make_crd_hg.o _make_crd_hg.f pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o make_crd_hg make_crd_hg.o ../lib/amopen.o ../lib/mexit.o pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead pathcc -c -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o molsurf.o molsurf.c pathcc -D_FILE_OFFSET_BITS=64 -D_LARGEFILE_SOURCE -O1 -o molsurf molsurf.o -lm mv make_crd_hg molsurf ../../exe cp mm_pbsa.pl mm_pbsa_statistics.pl ../../exe make[1]: Leaving directory `/usr/local/amber9/src/mm_pbsa' cd pbsa; make install make[1]: Entering directory `/usr/local/amber9/src/pbsa' pathf90 -cpp -E -P constants.f > _constants.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o constants.o _constants.f pathf90 -cpp -E -P decomp.f > _decomp.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o decomp.o _decomp.f pathf90 -cpp -E -P icosasurf.f > _icosasurf.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o icosasurf.o _icosasurf.f pathf90 -cpp -E -P egb.f > _egb.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o egb.o _egb.f pathf90 -cpp -E -P fastwt.f > _fastwt.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o fastwt.o _fastwt.f pathf90 -cpp -E -P pbsa.f > _pbsa.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pbsa.o _pbsa.f pathf90 -cpp -E -P runmd.f > _runmd.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o runmd.o _runmd.f pathf90 -cpp -E -P runmin.f > _runmin.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o runmin.o _runmin.f pathf90 -cpp -E -P findmask.f > _findmask.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o findmask.o _findmask.f pathf90 -cpp -E -P mdread.f > _mdread.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mdread.o _mdread.f call cnstphread(ix(icpstinf),ix(icpresst),ix(icpptcnt), & ^ pathf95-1279 pathf90: WARNING MDREAD2, File = _mdread.f, Line = 1821, Column = 25 Procedure "CNSTPHREAD" is defined at line 750 (_mdread.f). The type of this argument does not agree with dummy argument "STATEINF". pathf95: PathScale(TM) Fortran Version 2.5 (f14) Fri Nov 24, 2006 16:44:03 pathf95: 2323 source lines pathf95: 0 Error(s), 1 Warning(s), 0 Other message(s), 0 ANSI(s) pathf95: "explain pathf95-message number" gives more information about each message pathf90 -cpp -E -P rdparm.f > _rdparm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rdparm.o _rdparm.f pathf90 -cpp -E -P getcor.f > _getcor.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o getcor.o _getcor.f pathf90 -cpp -E -P sa_driver.f > _sa_driver.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o sa_driver.o _sa_driver.f pathf90 -cpp -E -P pb_force.f > _pb_force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pb_force.o _pb_force.f pathf90 -cpp -E -P np_force.f > _np_force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o np_force.o _np_force.f pathf90 -cpp -E -P force.f > _force.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o force.o _force.f pathf90 -cpp -E -P is_init.f > _is_init.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o is_init.o _is_init.f pathf90 -cpp -E -P pb_exmol.f > _pb_exmol.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pb_exmol.o _pb_exmol.f pathf90 -cpp -E -P pb_mpfrc.f > _pb_mpfrc.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pb_mpfrc.o _pb_mpfrc.f pathf90 -cpp -E -P pb_direct.f > _pb_direct.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pb_direct.o _pb_direct.f pathf90 -cpp -E -P pb_list.f > _pb_list.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o pb_list.o _pb_list.f pathf90 -cpp -E -P ene.f > _ene.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o ene.o _ene.f pathf90 -cpp -E -P printe.f > _printe.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o printe.o _printe.f pathf90 -cpp -E -P locmem.f > _locmem.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o locmem.o _locmem.f pathf90 -cpp -E -P echoin.f > _echoin.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o echoin.o _echoin.f pathf90 -cpp -E -P parallel.f > _parallel.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o parallel.o _parallel.f pathf90 -cpp -E -P shake.f > _shake.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o shake.o _shake.f pathf90 -cpp -E -P mdwrit.f > _mdwrit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mdwrit.o _mdwrit.f pathf90 -cpp -E -P minrit.f > _minrit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o minrit.o _minrit.f pathf90 -cpp -E -P set.f > _set.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o set.o _set.f pathf90 -cpp -E -P setmm.f > _setmm.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o setmm.o _setmm.f pathf90 -cpp -E -P dynlib.f > _dynlib.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o dynlib.o _dynlib.f pathf90 -cpp -E -P mdfil.f > _mdfil.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mdfil.o _mdfil.f pathf90 -cpp -E -P nmlsrc.f > _nmlsrc.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o nmlsrc.o _nmlsrc.f pathf90 -cpp -E -P rstack.f > _rstack.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rstack.o _rstack.f pathf90 -cpp -E -P istack.f > _istack.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o istack.o _istack.f pathf90 -cpp -E -P rfree.f > _rfree.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rfree.o _rfree.f pathf90 -cpp -E -P rgroup.f > _rgroup.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o rgroup.o _rgroup.f pathf90 -cpp -E -P random.f > _random.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o random.o _random.f pathf90 -cpp -E -P amopen.f > _amopen.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o amopen.o _amopen.f pathf90 -cpp -E -P debug.f > _debug.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o debug.o _debug.f pathf90 -cpp -E -P degcnt.f > _degcnt.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o degcnt.o _degcnt.f pathf90 -cpp -E -P mexit.f > _mexit.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o mexit.o _mexit.f pathf90 -cpp -E -P new_time.f > _new_time.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o new_time.o _new_time.f pathf90 -cpp -E -P matinv.f > _matinv.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o matinv.o _matinv.f pathf90 -cpp -E -P assert.f > _assert.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o assert.o _assert.f pathf90 -cpp -E -P veclib.f > _veclib.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o veclib.o _veclib.f pathf90 -cpp -E -P constantph.f > _constantph.f pathf90 -c -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -freeform -o constantph.o _constantph.f cd ../lib; make sys.a make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `sys.a' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' cd ../lib; make nxtsec.o make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `nxtsec.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' cd ../lapack; make make[2]: Entering directory `/usr/local/amber9/src/lapack' Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' ar rv lapack.a dsyev.o dsygv.o dlansy.o dsytrd.o dorgtr.o dsteqr.o dsterf.o dlascl.o dlamch.o xerbla.o ilaenv.o dlassq.o dsytd2.o dlatrd.o dorgql.o dorgqr.o dlasrt.o dlaset.o dlanst.o dlaev2.o dlasr.o dlapy2.o dlartg.o dlae2.o dorg2r.o dlarft.o dlarfb.o dorg2l.o dlarfg.o dlarf.o dspev.o dlansp.o dsptrd.o dopgtr.o dppsv.o dspsv.o dgeev.o dsptrs.o dsptrf.o dpptrs.o dpptrf.o dgebak.o dtrevc.o dlacpy.o dhseqr.o dorghr.o dgehrd.o dgebal.o dlange.o dlabad.o dlahqr.o dlarfx.o dlanhs.o dlaln2.o dgehd2.o dlahrd.o dlanv2.o dladiv.o dgerq2.o dorm2r.o dlarnv.o dgeqr2.o dlaruv.o dspevd.o dstedc.o dopmtr.o dlaed0.o dlaed1.o dlaed7.o dlaeda.o dlaed8.o dlaed9.o dlamrg.o dlaed2.o dlaed3.o dpotrf.o dsygst.o dpotf2.o dsygs2.o dlaebz.o dlagtf.o dlagts.o dormqr.o dormql.o dorm2l.o dlaed4.o dlaed5.o dlaed6.o ieeeck.o dsyevx.o dsyevd.o dstebz.o dstein.o dormtr.o zheev.o lsame.o zlanhe.o zlascl.o zhetrd.o zungtr.o zsteqr.o zlassq.o zlatrd.o zhetd2.o zungql.o zungqr.o zlasr.o zlaset.o zlacgv.o zlarfg.o zung2l.o zlarft.o zlarfb.o zung2r.o dlapy3.o zladiv.o zlarf.o r - dsyev.o r - dsygv.o r - dlansy.o r - dsytrd.o r - dorgtr.o r - dsteqr.o r - dsterf.o r - dlascl.o r - dlamch.o r - xerbla.o r - ilaenv.o r - dlassq.o r - dsytd2.o r - dlatrd.o r - dorgql.o r - dorgqr.o r - dlasrt.o r - dlaset.o r - dlanst.o r - dlaev2.o r - dlasr.o r - dlapy2.o r - dlartg.o r - dlae2.o r - dorg2r.o r - dlarft.o r - dlarfb.o r - dorg2l.o r - dlarfg.o r - dlarf.o r - dspev.o r - dlansp.o r - dsptrd.o r - dopgtr.o r - dppsv.o r - dspsv.o r - dgeev.o r - dsptrs.o r - dsptrf.o r - dpptrs.o r - dpptrf.o r - dgebak.o r - dtrevc.o r - dlacpy.o r - dhseqr.o r - dorghr.o r - dgehrd.o r - dgebal.o r - dlange.o r - dlabad.o r - dlahqr.o r - dlarfx.o r - dlanhs.o r - dlaln2.o r - dgehd2.o r - dlahrd.o r - dlanv2.o r - dladiv.o r - dgerq2.o r - dorm2r.o r - dlarnv.o r - dgeqr2.o r - dlaruv.o r - dspevd.o r - dstedc.o r - dopmtr.o r - dlaed0.o r - dlaed1.o r - dlaed7.o r - dlaeda.o r - dlaed8.o r - dlaed9.o r - dlamrg.o r - dlaed2.o r - dlaed3.o r - dpotrf.o r - dsygst.o r - dpotf2.o r - dsygs2.o r - dlaebz.o r - dlagtf.o r - dlagts.o r - dormqr.o r - dormql.o r - dorm2l.o r - dlaed4.o r - dlaed5.o r - dlaed6.o r - ieeeck.o r - dsyevx.o r - dsyevd.o r - dstebz.o r - dstein.o r - dormtr.o r - zheev.o r - lsame.o r - zlanhe.o r - zlascl.o r - zhetrd.o r - zungtr.o r - zsteqr.o r - zlassq.o r - zlatrd.o r - zhetd2.o r - zungql.o r - zungqr.o r - zlasr.o r - zlaset.o r - zlacgv.o r - zlarfg.o r - zung2l.o r - zlarft.o r - zlarfb.o r - zung2r.o r - dlapy3.o r - zladiv.o r - zlarf.o ranlib lapack.a make[2]: Leaving directory `/usr/local/amber9/src/lapack' cd ../blas; make make[2]: Entering directory `/usr/local/amber9/src/blas' Makefile:7: warning: overriding commands for target `.f.o' ../config.h:82: warning: ignoring old commands for target `.f.o' ar rv blas.a dasum.o daxpy.o dcabs1.o dcopy.o ddot.o dgbmv.o dgemm.o dgemv.o dger.o dnrm2.o drot.o drotg.o dsbmv.o dscal.o dspmv.o dspr.o dspr2.o dswap.o dsymm.o dsymv.o dsyr.o dsyr2.o dsyr2k.o dsyrk.o dtbmv.o dtbsv.o dtpmv.o dtpsv.o dtrmm.o dtrmv.o dtrsm.o dtrsv.o dummy.o dzasum.o dznrm2.o idamax.o isamax.o lsame.o scopy.o sswap.o sscal.o sasum.o snrm2.o sdot.o ssyr2k.o saxpy.o sgemv.o ssyr2.o ssymv.o sgemm.o strmm.o strmv.o sger.o zher2k.o zswap.o zgemv.o zhemv.o zscal.o zdotc.o zaxpy.o zher2.o zdscal.o ztrmv.o zcopy.o ztrmm.o zgemm.o zgerc.o r - dasum.o r - daxpy.o r - dcabs1.o r - dcopy.o r - ddot.o r - dgbmv.o r - dgemm.o r - dgemv.o r - dger.o r - dnrm2.o r - drot.o r - drotg.o r - dsbmv.o r - dscal.o r - dspmv.o r - dspr.o r - dspr2.o r - dswap.o r - dsymm.o r - dsymv.o r - dsyr.o r - dsyr2.o r - dsyr2k.o r - dsyrk.o r - dtbmv.o r - dtbsv.o r - dtpmv.o r - dtpsv.o r - dtrmm.o r - dtrmv.o r - dtrsm.o r - dtrsv.o r - dummy.o r - dzasum.o r - dznrm2.o r - idamax.o r - isamax.o r - lsame.o r - scopy.o r - sswap.o r - sscal.o r - sasum.o r - snrm2.o r - sdot.o r - ssyr2k.o r - saxpy.o r - sgemv.o r - ssyr2.o r - ssymv.o r - sgemm.o r - strmm.o r - strmv.o r - sger.o r - zher2k.o r - zswap.o r - zgemv.o r - zhemv.o r - zscal.o r - zdotc.o r - zaxpy.o r - zher2.o r - zdscal.o r - ztrmv.o r - zcopy.o r - ztrmm.o r - zgemm.o r - zgerc.o ranlib blas.a make[2]: Leaving directory `/usr/local/amber9/src/blas' pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -freeform -o pbsa constants.o pbsa.o runmd.o runmin.o mdread.o rdparm.o getcor.o force.o is_init.o sa_driver.o np_force.o pb_force.o pb_exmol.o pb_mpfrc.o pb_direct.o pb_list.o egb.o ene.o decomp.o icosasurf.o findmask.o printe.o locmem.o fastwt.o echoin.o parallel.o shake.o mdwrit.o minrit.o set.o setmm.o dynlib.o mdfil.o nmlsrc.o rstack.o istack.o rfree.o rgroup.o random.o amopen.o debug.o degcnt.o mexit.o new_time.o matinv.o assert.o veclib.o constantph.o ../lib/sys.a ../lib/nxtsec.o \ ../lapack/lapack.a ../blas/blas.a pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead /bin/mv pbsa ../../exe make[1]: Leaving directory `/usr/local/amber9/src/pbsa' cd etc; make install make[1]: Entering directory `/usr/local/amber9/src/etc' pathf90 -cpp -E -P ambpdb.f > _ambpdb.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ambpdb.o _ambpdb.f pathf90 -cpp -E -P forFIRSTtype.f > _forFIRSTtype.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o forFIRSTtype.o _forFIRSTtype.f pathf90 -cpp -E -P forFIRSTbond.f > _forFIRSTbond.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o forFIRSTbond.o _forFIRSTbond.f pathf90 -cpp -E -P forFIRSThbond.f > _forFIRSThbond.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o forFIRSThbond.o _forFIRSThbond.f pathf90 -cpp -E -P forFIRSTteth.f > _forFIRSTteth.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o forFIRSTteth.o _forFIRSTteth.f pathf90 -cpp -E -P forFIRSToutp.f > _forFIRSToutp.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o forFIRSToutp.o _forFIRSToutp.f cd ../lib ; ./Makelist ../lib/amopen.o ../lib/mexit.o ../lib/nxtsec.o make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `amopen.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `mexit.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' make[2]: Entering directory `/usr/local/amber9/src/lib' make[2]: `nxtsec.o' is up to date. make[2]: Leaving directory `/usr/local/amber9/src/lib' pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o ambpdb ambpdb.o forFIRSTtype.o forFIRSTbond.o forFIRSThbond.o forFIRSTteth.o forFIRSToutp.o ../lib/amopen.o ../lib/mexit.o ../lib/nxtsec.o pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead pathf90 -cpp -E -P nucgen.f > _nucgen.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o nucgen.o _nucgen.f pathf90 -cpp -E -P ngfil.f > _ngfil.f pathf90 -c -O0 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -o ngfil.o _ngfil.f pathf90 -O3 -intrinsic=PGI -intrinsic=fdate -fno-unsafe-math-optimizations -static -o nucgen nucgen.o ngfil.o ../lib/amopen.o ../lib/mexit.o ../lib/nxtsec.o pathf90 WARNING: Under Linux, -static is a linker option for using static libraries; if you wanted to put local data in static area, use -static-data instead pathCC -c -o elsize.o elsize.cc In file included from /usr/include/c++/4.1.0/string:52, from /usr/include/c++/4.1.0/bits/locale_classes.h:47, from /usr/include/c++/4.1.0/bits/ios_base.h:47, from /usr/include/c++/4.1.0/ios:48, from /usr/include/c++/4.1.0/istream:44, from /usr/include/c++/4.1.0/fstream:44, from elsize.cc:74: /usr/include/c++/4.1.0/bits/basic_string.h: In member function `bool std::basic_string<_CharT, _Traits, _Alloc>::_M_disjunct(const _CharT*) const ': /usr/include/c++/4.1.0/bits/basic_string.h:329: error: parse error before `;' token make[1]: *** [elsize.o] Error 1 make[1]: Leaving directory `/usr/local/amber9/src/etc' make: *** [serial] Error 2