[Xplor-nih] Torsion potential in other solvents
Charles at Schwieters.org
Charles at Schwieters.org
Mon Mar 19 17:49:56 EDT 2007
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Hello Léon--
>
> Are the following rama related commands in the anneal.py the correct
> ones to use the Rama torsion angle database in my case?
yes.
>
> I'm using the anneal.py script (eginput/gb1_rdc) as a template to my
> calculations, though not using rdc stuff. Commented all RAMA stuff in
> my first runs.
that should work. Please let us know if you have probelms.
best regards--
Charles
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