[gmx-users] PBC problem
David van der Spoel
spoel at xray.bmc.uu.se
Mon Jul 12 16:01:31 CEST 2004
On Mon, 2004-07-12 at 15:30, Xavier Periole wrote:
> Andrea Carotti wrote:
>
> >Dear Xavier,
> > trying your command, i have the message:
> >invalid argument -o for option -fit...
> >There is something i'm missing?
> >TNX again
> >
you need a refernce structure or tpr
> >
> I can't think about something wrong. I just tried again on a trajectory
> of mine and it went fine !!! Which version of Gromacs are you using ??
> Can try to put "yes" in argument but it is not supposed to need it !!
>
> XAvier
--
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://xray.bmc.uu.se/~spoel
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