Hi
I was wondering if there is a way to determine the water box size from the
output files after the simulation run is over
Thanks
Rabab Toubar
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Rabab Toubar wrote:
Hi
I was wondering if there is a way to determine the water box size from the
output files after the simulation run is over
Box vectors are printed to the output coordinate file (final snapshot) and can
be extracted from along the trajectory from the .edr file.
Subject: Re: [gmx-users] water box size from output files
To: Discussion list for GROMACS users gmx-users@gromacs.org
Date: Monday, July 25, 2011, 11:15 AM
Rabab Toubar wrote:
Hi
I was wondering if there is a way to determine the
water box size from the output files after the simulation
...@vt.edu wrote:
From: Justin A. Lemkul jalem...@vt.edu
Subject: Re: [gmx-users] water box size from output files
To: Discussion list for GROMACS users gmx-users@gromacs.org
Date: Monday, July 25, 2011, 11:15 AM
Rabab Toubar wrote:
Hi
I was wondering if there is a way to determine
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