[gmx-users] PBC only in xy direction

Berk Hess gmx3 at hotmail.com
Thu Dec 11 10:50:38 CET 2008


This is not possible in 3.3.

But in practice you almost never need this,
since it is far more efficient to use pbc=xyz and have a slab of vacuum
in between the periodic images in z.


> Date: Thu, 11 Dec 2008 10:30:55 +0100
> From: andreamuntean at gmail.com
> To: gmx-users at gromacs.org
> Subject: [gmx-users] PBC only in xy direction
> Hi gmx-users,
> We are using the version 3.3.3. Is there also a posibility to have pbc
> only in xy direction (as I saw it is possible in Gromacs 4.0)? The
> manual says nothing about that.
> Thank you in advance.
> Best regards,
> Andrea
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