[gmx-users] Force field parameter

Mark Abraham mark.j.abraham at gmail.com
Sat Jul 7 19:52:19 CEST 2018


Hi,

Your other good approach is to contact the authors to ask them to share
their methodology fully, ie force field files.

Mark

On Sat, Jul 7, 2018, 13:47 Soham Sarkar <soham9038 at gmail.com> wrote:

> Dear All,
>              Can anyone please tell me, where from I get the parameters for
> Osmotic, Kast, Netz force field like the files OPLS, CHARMM which is
> already in GROMACS? I have got the files for the KBFF force field but not
> these three.  The paper by Dias and group
> https://journals.aps.org/prl/abstract/10.1103/PhysRevLett.119.108102 used
> different force field. I want to go that way.Please provide me with the
> links or relevant websites for the filese regarding the force field. Thanks
> in advance.
> -Soham
>
> --
> SOHAM SARKAR
> Junior Research Fellow
> Department of Chemistry
> INDIAN INSTITUTE OF TECHNOLOGY BOMBAY
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