[EMAIL PROTECTED] wrote:
==============Original message text===============
From: [EMAIL PROTECTED]
Date: Mon, 24 Jul 2006 20:00:57 EDT
Subject: Re: [gmx-users] REST variant of REMD
Hi i'm getting this line from a nohup.out file. I am trying to run grompp
in a loop for several files and the script is not working. What does this
mean?
there's an error in the top file. Look for things like quotes (') and
remove them.
creating statusfile for 1 node...
calling /lib/cpp...
cpp exit code: 256
Tried to execute: '/lib/cpp -I../top
-I/home/diana/software/gromacs-3.3/share/gromacs/top 1bq8zn.top >
gromppgr1Igp'
The '/lib/cpp' command is defined in the .mdp file
processing topology...
turning H bonds into constraints...
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--
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
[EMAIL PROTECTED] [EMAIL PROTECTED] http://folding.bmc.uu.se
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