[gmx-users] automated analysis
Florian Haberl
Florian.Haberl at chemie.uni-erlangen.de
Thu Dec 15 19:38:05 CET 2005
hi
simple scripts can do this in your favorite language
something like
echo -e '0\n' | g_rmsd will choose your command
On Thursday 15 December 2005 22:26, Anthony Cruz wrote:
> But in the case of g_rmsd, g_rmsf, and other that I have to select a group or
> input some options, How I can specify this options in the Scripps.
>
>
> On Wednesday 14 December 2005 12:10 pm, David van der Spoel wrote:
> > Anthony Cruz wrote:
> > > Hi User:
> > > I want to know if is possible to make a script for analysis of a
> > > trajectory. Where I specify the options I want to use and the script make
> > > all the rest.
> >
> > you have to write the script.
> >
> > > Best regards,
> > > Anthony
> > > _______________________________________________
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--
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Florian Haberl
Computer-Chemie-Centrum
Universitaet Erlangen/ Nuernberg
Naegelsbachstr 25
D-91052 Erlangen
Mailto: florian.haberl AT chemie.uni-erlangen.de
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