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Message: 1
Date: Tue, 08 Nov 2011 17:55:49 +1100
From: Mark Abraham
Subject: Re: [gmx-users] remd with different potential at different
temperature
To: Discussion list for GROMACS users
Messa
On 8/11/2011 5:43 PM, ?? wrote:
dear teacher,
how can i do remd with different non-bond potential at different
temperature ?
easy to say ,can i use different *.top at diferent temperature.
Probably. Try a simple case and see. The REMD implementation checks only
certain critical quantities ar
dear teacher,
how can i do remd with different non-bond potential at different
temperature ?
easy to say ,can i use different *.top at diferent temperature.
if not ,can you give me some suggestions to rewrite the gromacs codes.
thanks!!
regards,
PHD, Bo Du
Department of Polymer Science and Engine
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