[gmx-users] rotational diffusion of proteins

Paymon Pirzadeh ppirzade at ucalgary.ca
Mon Aug 2 21:51:13 CEST 2010


Hello,
If we have the .tpr and .xtc outputs, what is the procedure (what
GROMACS utilities should be used)  to calculate rotational diffusion
constant of a protein?
Regards,

Paymon




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