Hi Lum, These values have to be chosen very icarefully. Many artifacts can show up due to poorly chosen cutoff. I would suggest to get the parameters from a reproducible publication or something.
amit On Fri, Feb 26, 2010 at 8:49 AM, Lum Nforbi <lumngwe...@gmail.com> wrote: > Hi all, > > Please, can someone let me know if the choice of the value of rlist, rvdw > and rcoulomb is related to or depends in someway to the distance between > atoms on a lennard-jones potential plot? > > I appreciate your answers. > > Lum > > -- > gmx-users mailing list gmx-users@gromacs.org > http://lists.gromacs.org/mailman/listinfo/gmx-users > Please search the archive at http://www.gromacs.org/search before posting! > Please don't post (un)subscribe requests to the list. Use the > www interface or send it to gmx-users-requ...@gromacs.org. > Can't post? Read http://www.gromacs.org/mailing_lists/users.php >
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