[gmx-users] Buckingham potential

David van der Spoel spoel at xray.bmc.uu.se
Fri Jul 14 09:53:42 CEST 2006


ARGYRIOS KARATRANTOS wrote:
> Hi, 
> 
> what values the [defaults]  parameters must have,
> ( non-bonded function type       compination rule  )
> 
> in order to be able to use Buckingham potential for the non-bonded interaction?
2

> Argyris Karatrantos
> _______________________________________________
> 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.
> Can't post? Read http://www.gromacs.org/mailing_lists/users.php


-- 
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://folding.bmc.uu.se
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++



More information about the gromacs.org_gmx-users mailing list