AMBER Archive (2000)

Subject: sander compile error with MPICH compiled by PGI compiler

From: Kouji Hauyama (hayama_at_lance.mecha.osakafu-u.ac.jp)
Date: Tue May 23 2000 - 07:34:15 CDT

Hi, everyone.
 I compiled sander with MPICH compiled by PGI compiler .
I run test program '4096wat' ,so down with error coment ...

 ---------------------------------------------------
 APPROXIMATING switch and d/dx switch using CUBIC SPLINE INTERPOLATION
 using 5000.0 points per unit in tabled values
 TESTING RELATIVE ERROR over r ranging from 0.0 to cutoff
| CHECK switch(x): max rel err = 0.2718E-14 at 2.447300
| CHECK d/dx switch(x): max rel err = 0.8388E-11 at 2.753760
 ---------------------------------------------------
     Total number of mask terms = 12288
     Total number of mask terms = 24576
| Total Ewald setup time = 0.30999999

------------------------------------------------------------------------------

  Unit 7 Error on OPEN:

  Unit 7 Error on OPEN:
[1] MPI Abort by user Aborting program !
[1] Aborting program!
p1_4121: p4_error: : 1
rm_l_1_4122: p4_error: interrupt SIGINT: 2
bm_list_4115: p4_error: net_recv read: probable EOF on socket: 1

Would you tell me how to solve this problem.
Thank you.