Gromacsers
I have been running jobs successfully for a while, submitting them directly,
but when I submitt them to the q (qsub) I get an error from grompp that it
can't find libXm.so.3. I recompiled with configure option
--without-motif-include, but that did not get rid of the problem. How
Nevermind, I made one using VMD, it solvated my protien just fine.
- Original Message -
From: WILLIAM R WELCH [EMAIL PROTECTED]
Date: Friday, February 2, 2007 3:25 pm
Subject: [gmx-users] genbox using TIP3P?
To: Discussion list for GROMACS users gmx-users@gromacs.org
Hello
I would
The links for Getting Started-Main Table of Contents on the
page(www.gromacs.org/blogcategory/page_2.html) are all broken. Does anyone
know of a way to access these files?
Will
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gmx-users mailing listgmx-users@gromacs.org
Hello, I am a brand new gromacs user--I have been banging my head against the
wall with the manual for some time, so if someone could be so gracious, I have
2 simple questions:
In the tutorial files I obtained in gromacs 3.3, on if I use pdb2gmx with no
file specified, I get the input/output
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