[gmx-users] Spherical orientational distribution function

Peter Fojan fp at bio.auc.dk
Mon Mar 25 13:54:06 CET 2002


Hi all,
can anybody give me a hint on how I can calculate the Spherical
orientational distribution function from a dynamics simulation in
Gromacs?
I want to calculate the Spherical orientational distribution function
for a sidechain of an aminoacid. The Calpha-Cbeta from an alanine in a
protein.
Thanks for your help,
   Peter




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