[gmx-users] mass of a index group
cseifert at bph.ruhr-uni-bochum.de
Thu Feb 12 15:12:37 CET 2009
after reading the man page of g_traj and some tests on its output, I can
not discover a way of getting the total mass of an index group (e.g.
On Thu, 2009-02-12 at 14:35 +0100, David van der Spoel wrote:
> Christian Seifert wrote:
> > Hi users!
> > Is there a gmx tool, which calculates the mass of one or more index
> > groups? The manual says something about a tool named "g_com", but it
> > seems, as if it does not belong to gmx4.0.3 anymore.
> try g_traj
> > Greetings,
> > Christian.
M. Sc. Christian Seifert
Department of Biophysics
University of Bochum
Tel: +49 (0)234 32 28363
Fax: +49 (0)234 32 14626
E-Mail: cseifert at bph.rub.de
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