[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.
Cheers
Gavin
    
    
More information about the gromacs.org_gmx-users
mailing list