[gmx-users] g_rama / mult

Tsjerk Wassenaar tsjerkw at gmail.com
Wed Jun 30 13:43:42 CEST 2010


Hi Shahab,

> I used  [ g_rama -f *.xtc -s *.tpr -o rama.xvg ] command for analysis of

Was that your actual command line? If you used a .tpr, why didn't it
have all the dihedrals defined then? How did you get it? Anyway, you
should be able to assert that the dihedrals mentioned are in fact your
phi/psi dihedrals and should have multiplicity of 3.

Cheers,

Tsjerk




-- 
Tsjerk A. Wassenaar, Ph.D.

post-doctoral researcher
Molecular Dynamics Group
Groningen Institute for Biomolecular Research and Biotechnology
University of Groningen
The Netherlands



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