[gmx-users] No pressure coupling in X direction
Sam David
samdav800 at gmail.com
Wed Jan 16 22:04:24 CET 2019
Hi
I have no idea about pull code but if you want pressure in a specific
direction you can use anisotropic coupling where it has xx yy zz xy xz yz
in your case xx=0, yy=p zz=p xy=xz=yz=0
check it online
Best
On Wed, Jan 16, 2019 at 1:50 PM Quyen Vu Van <vuqv.phys at gmail.com> wrote:
> Dear all,
> In pull code, I want to use *pull-coord1-geometry=direction-periodic* and
> Gromacs requires no pressure coupling in the pulling direction, which is
> x-direction in my case.
> How can I just use pressure coupling for y-z direction?
> Best regards,
> Quyen
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-request at gromacs.org.
>
More information about the gromacs.org_gmx-users
mailing list