on behalf of Mark Abraham
Sent: Fri 6/4/2010 9:35 PM
To: Discussion list for GROMACS users
Subject: Re: [gmx-users] taking snapshots of the protein after simulation
- Original Message -
From: Hassan Shallal
Date: Saturday, June 5, 2010 13:16
Subject: [gmx-users] taking snapshots of the
- Original Message -
From: Hassan Shallal
Date: Saturday, June 5, 2010 13:16
Subject: [gmx-users] taking snapshots of the protein after simulation
To: gmx-users@gromacs.org
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|
> Dear Gromacs users, > > I have had one o
Hassan Shallal wrote:
Dear Gromacs users,
I have had one of my studied proteins simulated in a 5 ns production.
Now, I wonder how can I get, let's say, 100 coordinates files, each file
represent the coordinates of the protein at certain time during the
simulation, for example, each 50 ps OR
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