[gmx-users] Fatal error: Frame contains more atoms than expected
David van der Spoel
spoel at xray.bmc.uu.se
Tue May 11 13:02:40 CEST 2004
On Tue, 2004-05-11 at 12:22, SANTINI sebastien wrote:
> On Tuesday 11 May 2004 11:56, David van der Spoel wrote:
> > then I don't know. If you have saved the trajectory in the trr file as
> > well, you can try to restart the simulation from 1800 ps.
> thanks for your help,
> I have already tried to restart the simulation from 1.790 ns.
> the simulation have crashed around 200 ps after with the same problem.
> If I find somthing I will tell you.
Please try to restart the same tpr, and see if it is reproducible.
Could it be that your simulation is exploding?
> thanks a lot.
David van der Spoel, PhD, Assist. 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://xray.bmc.uu.se/~spoel
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