[gmx-users] Pressure through one direction

[ali akgün]

I mean can i run npt only one direction?

On Tue, Nov 28, 2017 at 10:53 PM, Wes Barnett <w.barnett at columbia.edu>
wrote:

> On Tue, Nov 28, 2017 at 12:25 PM, ali akgün <ali.akgunphys at gmail.com>
> wrote:
>
> > Hi,
> >
> > Can i generate mdp file for pressure through one direction system.For
> > example:
> >
> > Ref pressure:
> >
> > X direction:        1.0 bar
> > Other direction:  0.0 bar
> >
>
>
> Yes, see the options here:
> http://manual.gromacs.org/documentation/2016.4/user-guide/mdp-options.html
>
>
> --
> James "Wes" Barnett
> Postdoctoral Research Scientist
> Department of Chemical Engineering
> Kumar Research Group <http://www.columbia.edu/cu/kumargroup/>
> Columbia University
> w.barnett at columbia.edu
> http://wbarnett.us
> --
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