[gmx-users] Checking files .xtc .trr .edr
David
spoel at xray.bmc.uu.se
Wed Oct 30 10:57:23 CET 2002
On Wed, 2002-10-30 at 00:59, Erik Lindahl wrote:
> Alan Wilter Sousa da Silva wrote:
>
> >Hi List!
> >
> > I run GMX in a cluster and some processors write files via NFS.
> >However, the NFS server crashed, stoped for a while and then was rebooted.
> >How could I be sure whether my .xtc .trr and .edr files was, or not,
> >corrupted? I kept the jobs running.
> >
> >
>
> If you use hard NFS mounts (the default, never EVER use soft...) you
> should be perfectly OK. The client will just continute trying to write
> until the server comes up again, without dropping any data.
In a perfect world yes, but not with redhat 7.3 for example. We have
lots of weird things going on when our rh73 server goes down. Machines
can not be logged into anymore, the clients hanging on NFS...
>
> If you are thinking of file system problems, run fsck, and possible test
> trajectories with gmxcheck. If it gets to the last frame you should
> probably be ok; I've never seen an error that silently corrupts the data
> while maintaining the overall structure...
gmxcheck will give you clues indeed.
> Cheers,
>
> Erik
>
>
>
> _______________________________________________
> gmx-users mailing list
> gmx-users at gromacs.org
> http://www.gromacs.org/mailman/listinfo/gmx-users
> Please don't post (un)subscribe requests to the list. Use the
> www interface or send it to gmx-users-request at gromacs.org.
--
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, Biomedical center, Dept. of Biochemistry
Husargatan 3, Box 576, 75123 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://zorn.bmc.uu.se/~spoel
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
More information about the gromacs.org_gmx-users
mailing list