[gmx-users] kappa in Generalized reaction field
kameda-tomoshi at aist.go.jp
Tue May 16 07:35:31 CEST 2006
> >Do we want to keep this code at all?
> Good question.
> I think simulating ionic solutions with reaction-field causes large
> unless the concentration is very high and the cut-off quite long.
> PME is a much better choice.
Recently, I read a paper, which shows the GRF and PME yielded results
consistent with experiment by using GROMACS ......
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