[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 !!
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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