[gmx-users] calculate RDC from MD trajectory
gurunath.katagi at gmail.com
Sat Oct 27 00:25:53 CEST 2012
I want to compare the RDC data from MD simulation of a protein with those
derived from RDC.
I was wondering whether there is any program or implementation for
calculation of RDC in gromacs..
There have been studies which have computed RDC from md simulation
trajectories, for example, .
Kindly let me know, any function in gromacs or external program which can
do that ...
More information about the gromacs.org_gmx-users