[gmx-users] Force-switch algorithm

[Mark Abraham]

Hi,

If you want to implement the force-switch modifier, that's what type have
to do. There's no alternative.

Mark

On Sun, 3 Jan 2016 09:10 Pallavi Banerjee <
pallavisept at students.iiserpune.ac.in> wrote:

> Thank you for your reply, Justin! From having read about the algorithm in
> the manual, it looks like it would be a difficult task to modify the input
> potential. Could you suggest other ways of doing the same?
>
> I want to use the vdw-modifier 'force-switch', but the LJ potentials are
> fed in a tabulated format. On running the program, I run into the following
> error: "Potential modifiers other than potential-shift are only implemented
> for LJ cut-off". Could you suggest a work-around?
>
> Many Thanks!
>
> -Pallavi Banerjee
> --
> Gromacs Users mailing list
>
> * Please search the archive at
> http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before
> posting!
>
> * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
>
> * For (un)subscribe requests visit
> https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or
> send a mail to gmx-users-request at gromacs.org.
>