[gmx-users] g_msd freeze
Mark Abraham
Mark.Abraham at anu.edu.au
Wed Apr 9 15:34:28 CEST 2008
Kateřina Hynštová wrote:
> Hi all,
>
> I had a problem that the g_msd tool froze at
> Reading frame 0 time 0.000
> with no visible problems in input files or compilation.
> Thanks to your advices I was able to trace the mistake back to the box
> size in the structure file.
That suggests there may be a code bug. More information would be
welcome, to help prevent the problem recurring.
Mark
More information about the gromacs.org_gmx-users
mailing list