[gmx-users] g_rmsf Segmentation fault
David van der Spoel
spoel at xray.bmc.uu.se
Wed Oct 31 15:52:58 CET 2007
Tommy Carstensen wrote:
> To the gmx-users,
>
> When executing:
> g_rmsf -f traj.trr -s topol.tpr -o rmsf.xvg -aniso
>
> I get the following error after running through all the frames:
> Segmentations fault
>
> If I don't include the aniso flag I don't get an segfault. Can anyone
> explain to me, why it is not working with the aniso flag?
probably a bug. maybe it works if you input a pdbfile with reference B
values. Anyway you're welcome to submit a bugzilla, please upload input
files to reproduce the problem.
>
> Kind regards,
> Tommy
>
> Tommy Carstensen
> UCD School of Biomolecular and Biomedical Sciences
> Conway Institute
> University College Dublin
> Dublin 4, Ireland
>
> http://enzyme.ucd.ie/group_members/tommy
>
>
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--
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://folding.bmc.uu.se
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