[gmx-users] truncating LJ potentials

[Mark Abraham]

Hi,

Tabulated interactions are the way to get such stuff done (but still
missing from the Verlet scheme).

Mark

On Mon, Jul 11, 2016 at 7:42 PM Irem Altan <irem.altan at duke.edu> wrote:

> Hi,
>
> I’m trying to figure out how to truncate the LJ potentials at the
> repulsive part. I found a similar question and answer in the mail list from
> 2011: http://comments.gmane.org/gmane.science.biology.gromacs.user/37093
>
> Is the answer still the same? Has a newer/easier way of this been
> implemented since 2011?
>
> Best,
> Irem
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