[gmx-users] [Fwd: PMF or umbrella sampling]
David van der Spoel
spoel at xray.bmc.uu.se
Fri Dec 9 10:59:47 CET 2005
-------- Original Message --------
Subject: PMF or umbrella sampling
Date: Fri, 9 Dec 2005 16:51:26 +0800
From: nchc <c00jsw00 at nchc.org.tw>
To: David van der Spoel <spoel at xray.bmc.uu.se>
Dear all ,
Someone could give me a correct example of setting PMF in gromacs .
THX
James
--
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://xray.bmc.uu.se/~spoel
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