[gmx-users] vdw-type and DispCorr

Mark Abraham mark.j.abraham at gmail.com
Fri Jul 22 01:42:32 CEST 2016


Hi,

No. Please check out the emails on this topic earlier today :-)

Mark

On Fri, 22 Jul 2016 01:33 yunshi11 . <yunshi09 at gmail.com> wrote:

> Hello everyone,
>
> Should DispCorr be turned off if I am using vdw-type = PME (since PME
> already accounts for long range vdw interactions)?
>
> Also I am curious if this vdw PME option is designed to suit some specific
> force fields?
>
> Thanks for any thoughts.
>
> Yun
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