[gmx-users] bug in g_msd

Gavin Melaugh gmelaugh01 at qub.ac.uk
Thu Mar 15 17:56:36 CET 2012

Hi all

Is there a bug with g_msd when using the -mol flag. I have my own
program that calculates the MSD. If I compare it with the gromacs
utility for one system the curves are the exact same, however when I
compare with another system th curves are very different. Someone else
mentioned something similar a few days ago, so I was just wondering if
this was the case.



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