[gmx-users] PBC problem
Andrea Carotti
and.carotti at farmchim.uniba.it
Mon Jul 12 15:47:42 CEST 2004
I'm using gmx 3.2.1 and trr files for input and output (instead of xtc)
and the option Yes did not work (same error message).
:-(
Andrea
----- Original Message -----
From: "Xavier Periole" <x.periole at chem.rug.nl>
To: "Discussion list for GROMACS users" <gmx-users at gromacs.org>
Sent: Monday, July 12, 2004 3:30 PM
Subject: Re: [gmx-users] PBC problem
> 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
> >
> >
> 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
>
> --
> ----------------------------------------------
>
> Xavier Periole - Ph.D.
>
> Dept. of Biophysical Chemistry / MD Group
> Univ. of Groningen
> Nijenborgh 4
> 9747 AG Groningen
> The Netherlands
>
> Tel: +31-503634329
> Fax: +31-503634800
> email: x.periole at chem.rug.nl
> web-page: http://md.chem.rug.nl/~periole
>
> ----------------------------------------------
>
>
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