[gmx-users] FW: rvdw

Berk Hess gmx3 at hotmail.com
Fri Jul 20 10:55:31 CEST 2007

>From: "Yin Jian" <smayinj at nus.edu.sg>
>Reply-To: Discussion list for GROMACS users <gmx-users at gromacs.org>
>To: "Discussion list for GROMACS users" <gmx-users at gromacs.org>
>Subject: RE: [gmx-users] FW: rvdw
>Date: Fri, 20 Jul 2007 16:40:09 +0800
>Hi Hess,
>Thanks for your comments, although we have difference in this
>topic. The carrier of depletion force at least for me is
>not sure. So we want to do a test anyway in this way.

Ah, now I understand what you want to do.

For that it would help to have different cut-offs.
We are (currently) not going to implement such a thing.
But is should not be too difficult to modify the cut-off
check for the neighborlist in ns.c.


Need a brain boost? Recharge with a stimulating game. Play now!  

More information about the gromacs.org_gmx-users mailing list