[gmx-users] [Fwd: simulation in microchannel]

David van der Spoel spoel at xray.bmc.uu.se
Fri Dec 3 17:15:29 CET 2004


-------- Forwarded Message --------
From: Budiono <yen_ono at yahoo.com>
To: spoel at xray.bmc.uu.se
Subject: simulation in microchannel
Date: Fri, 3 Dec 2004 07:58:45 -0800 (PST)
Hi, 
 
I'm a real gromacs' beginner,  i really need a big help.
 
i'm trying to simulate flow in a microchannel.
and as i know, "freeze groups" is right one to make microchannel wall,
isn't it ???
 
and  is it possible to use Gromacs to select the material for channel
wall, such as silicon, teflon, glasse etc, is it already provided in
Gromacs or do i have to make new topology ??
 
thank you very much
Budiono


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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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