[gmx-users] Number Error in XTC file

Mark Abraham mark.j.abraham at gmail.com
Tue Apr 28 16:42:34 CEST 2015


If that's the problem, use a machine with a real file system ;-)

Mark

On Tue, Apr 28, 2015 at 4:34 PM Jennifer Vo <quyviolet at gmail.com> wrote:

> Dear Mark,
> Many thanks for your answer. Is there anyway to overcome this?
> Regards,
> Jennifer
>
> On Tue, Apr 28, 2015 at 4:26 PM, Mark Abraham <mark.j.abraham at gmail.com>
> wrote:
>
> > Hi,
> >
> > Typically that means you're reading a trajectory of size > 2GB on a
> > filesystem that can't do that (e.g. a 32-bit one).
> >
> > Mark
> >
> > On Tue, Apr 28, 2015 at 4:20 PM Jennifer Vo <quyviolet at gmail.com> wrote:
> >
> > > Dear All,
> > > I have got the error in the end of trajectory converting: "Magic Number
> > > Error in XTC file (read -335790888, should be 1995)"
> > >
> > > trjconv -s md-1.tpr -f md-300ns-wat.xtc -o md_CA.pdb -n index_8pro.ndx
> > -pbc
> > > mol -ur compact -center -skip 1000
> > >
> > >
> > > Is there anybody know what`s the error about?
> > > Many thanks in advance.
> > > Jennifer
> > > --
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