calc free energy during dynamics

From: Eoin Galligan <paxeg_at_unix.ccc.nottingham.ac.uk>
Date: Thu 8 Mar 2001 11:23:10 +0000 (GMT)

Hi
I am interested in determing the free energy of my system during
dynamics within sander - could anyone point me in the right direction?

Thanks in advance
E.Galligan


tel: 0115 9515151 ext 66272
mobile: 07968 349629
mobile email: eoingalligan_at_sms.genie.co.uk
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Laboratory of Biophysics and Surface Analysis,
Institute of Pharmaceutical Sciences,
Nottingham University,
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Nottingham,
NG7 2RD,
UK
Received on Thu Mar 08 2001 - 03:23:10 PST
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