[gmx-users] Umbrella Sampling (Justin Lemkul)

amitbehra at chemeng.iisc.ernet.in amitbehra at chemeng.iisc.ernet.in
Fri Jun 10 06:37:06 CEST 2016


Hello all,
I was practicing the umbrella sampling tutorial by Dr. Justin Lemkul. In
my summary_distances.dat file there is only one column ( the column for
centre of mass is missing ).

Can anyone say what possible mistakes I must have done.

Regards,
Amit Behera
Dept. of Chemical Engg.,
IISc, India


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