[gmx-users] gromacs Query

[Mark Abraham]

Hi,

If you ask for .trr output, you get it. Stop using non-zero nst*out mdp
settings that you don't want.

Mark

On Mon, Apr 3, 2017 at 11:31 AM Aman Deep <r.amandeep2677 at gmail.com> wrote:

> sir,
>
> I have tried *nstxctout  *but it still making trr file ... is there any
> option to  make only xtc file ???
>
> On Mon, Apr 3, 2017 at 1:14 PM, Mark Abraham <mark.j.abraham at gmail.com>
> wrote:
>
> > Hi,
> >
> > See
> >
> http://www.gromacs.org/Documentation/How-tos/Reducing_Trajectory_Storage_
> > Volume
> >
> > Mark
> >
> > On Mon, Apr 3, 2017 at 9:27 AM Aman Deep <r.amandeep2677 at gmail.com>
> wrote:
> >
> > > sir is there any way to create only XTC file from mdrun only. the
> server
> > on
> > > which I am working is not providing enough space and my trr file is too
> > > much large.
> > >
> > > thank you
> > >
> > > --
> > > Aman Deep
> > > MSc Bioinformatics
> > > Jamia Millia Islamia
> > > New Delhi - 110025
> > > --
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> --
> Aman Deep
> MSc Bioinformatics
> Jamia Millia Islamia
> New Delhi - 110025
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
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>
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