[gmx-users] How to exclude 1-4 interactions within a given group?

[David van der Spoel]

On Wed, 2004-11-17 at 10:13 +0200, Markus O Kaukonen wrote:
> Dear All,
> 
> How to exclude 1-4 (LJ and coulomb) interactions within a given group
> when using opls force field?
> 
> I want to kill 1-4 interaction for this particular group only.
> energy_grp_excl seems to keep 1-4 interaction.
edit the topology file (pairs section)
> 
> Terveisin Markus
> 
-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,          75124 Uppsala, Sweden
phone:  46 18 471 4205          fax: 46 18 511 755
spoel at xray.bmc.uu.se    spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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