[gmx-users] Regarding g_covar

[R.Vidya Rajendran (10PHD013)]

Hello Everybody,

I am using g_covar with -xpmc flag in-oder to generate matrix of
atomic correlation coefficients. At present I am using g_covar script
given by Ran, which I downloaded from gromacs user modified script
pool.

Since Ran's script is for gromacs 3.3.3 and it not accept .trp input
from upgraded version (eg 4.5.5).

Anybody have upgraded g_covar which can do the same job.


regards
Vidya