Lemkul
Subject: Re: [gmx-users] Issue with domain decomposition between
v4.5.5 and 4.6.1
To: Discussion list for GROMACS users
Message-ID: <516bd18d.8000...@vt.edu>
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On 4/14/13 11:23 PM, Stephanie Teich-McGoldrick wrote:
e any suggestions on where I
should start tracking down this error? When I use particle decomposition my
simulations run fine.
Thanks in advance!
Stephanie
Message: 3
Date: Mon, 15 Apr 2013 06:08:13 -0400
From: Justin Lemkul
Subject: Re: [gmx-users] Issue with domain decomposition betwee
On 4/14/13 11:23 PM, Stephanie Teich-McGoldrick wrote:
Dear all,
I am running a NPT simulation of 33,534 tip4P waters, and I am using domain
decomposition as the parallelization scheme. Previously, I had been using
Gromacs version 4.5.5 but have recently installed and switched to Gromacs
versi
Dear all,
I am running a NPT simulation of 33,534 tip4P waters, and I am using domain
decomposition as the parallelization scheme. Previously, I had been using
Gromacs version 4.5.5 but have recently installed and switched to Gromacs
version 4.6.1. Using Gromacs 4.5.5 I can successfully run my wat
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