[gmx-users] A bug in gromacs tool 4.5
x.hu1982 at googlemail.com
Tue Aug 10 02:25:39 CEST 2010
I think the gromacs tools 4.5 may have a bug. So far I experienced that
several tools trjconv, g_rms, grmsf, g_covar, g_anaeig crash with a
segmentation fault if the trajectory read in does not have the same atom
number as the atom number in the .tpr file. It seems to be a systematic
problem. I can do the same analysis without any problems with the older
version of gromacs tools, i. e. version 4.0.7.
Hope it could be fixed soon. Thanks!
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