AMBER Archive (2006)

Subject: AMBER: error in AMBER 9.0

From: mkseo (seo_at_ualberta.ca)
Date: Tue May 23 2006 - 16:43:28 CDT

Hi Amber users,

I tried to run sander (serial and parallel version) in AMBER 9.0 with
the input which works fine in AMBER 7.0
I got the error message for both sanders of serial and parallel version.

"The READ statement on the file fort.9 cannot be completed because the
end of the file was reached. The program will stop."

What is this about? How can I solve this?

The installation of AMBER 9.0 is fine for both sanders.
Well, does the input have something wrong?
Can't I use the input which is generated from AMBER 7.0 in AMBER 9.0?

My input is the following:

------------------------------------------------------------------------
----------------------
Dynamic Simulation with Constant Temperature

  # Control section
  &cntrl
   ntwe=2000, ntwx=2000, ntwv=0, ntpr=2000,
   ntt=1, temp0=300.0, tempi=5.0, tautp=1.0,
   ntb=0, ntc=2, ntf=2, cut=9999.0,
   nstlim=250000, dt=0.0020,
   ntp=0,
   ntx=1, nmropt=1
  /
  &wt
   type='TEMP0', istep1=1, istep2=50000, value1=5.0, value2=300.0,
  /
  &wt
   type='TEMP0', istep1=50001, istep2=200000, value1=300.0, value2=300.0,
  /

  &wt
   type='END'
  &end
LISTOUT=POUT
DISANG = restraints_2.in
------------------------------------------------------------------------
---------------------

Thanks

-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber_at_scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo_at_scripps.edu