[gmx-users] A bug in gromacs tool 4.5

Xiaohu Hu x.hu1982 at googlemail.com
Tue Aug 10 02:25:39 CEST 2010

Hi all,

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!


More information about the gromacs.org_gmx-users mailing list