From: Osman Yogurtcu (karmatech_at_yahoo.co.uk)
Date: Thu Mar 24 2011 - 09:56:25 CDT
Hi Oguz,
I think in NAMD it is possible to get pairwise forces acting on each atom:
This might help:
http://portal.ku.edu.tr/~oyogurtcu/NAMDTUT/pair.html
Osman Yogurtcu
________________________________
From: oguz gurbulak <gurbulakoguz_at_yahoo.com>
To: namd-l_at_ks.uiuc.edu
Sent: Thursday, 24 March 2011, 7:02
Subject: namd-l: question about force information
Dear All,
Is it possible to get
output force information acting on each atom ( in the last record or during the
simulation ) in NAMD ? Could you please share your thoughts about this
issue ?
Kind regards.
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