[gmx-users] OPLS, RB dihedrals and LJ-14 interactions

[Lars Schaefer]

Hi Dele,
this issue was discussed here already. Check out 
http://www.gromacs.org/search/index.php
For OPLS, you generally do N O T exclude LJ14 interactoins.
Cheers, Lars

Bamidele Adisa wrote:

> hi,
> i'm running md simulations using OPLS forcefield.
> the gromacs manual says that when Ryckaert-Bellemans dihedrals are used,
> the LJ-14 interactions should be excluded.
> does this apply only to GROMACS and GROMOS forcefields or it also 
> applies to OPLS?
> thanks in advance.
> dele
>
> ______________________
> Bamidele Adisa
> Dept of Chemical Engineering
> Clemson University
> Clemson, SC 29634-0909
> 864-654-0586
> ______________________
>
> _______________________________________________
> gmx-users mailing list
> gmx-users at gromacs.org
> http://www.gromacs.org/mailman/listinfo/gmx-users
> Please don't post (un)subscribe requests to the list. Use the www 
> interface or send it to gmx-users-request at gromacs.org.