[gmx-users] Torsion analysis

João Henriques joao.m.a.henriques at gmail.com
Thu Aug 24 14:35:44 CEST 2017


gmx chi?

http://manual.gromacs.org/documentation/2016.3/onlinehelp/gmx-chi.html

I never used it though. I personally like to use PLUMED for this:

https://plumed.github.io/doc-v2.3/user-doc/html/_t_o_r_s_i_o_n.html

João

On Thu, Aug 24, 2017 at 1:43 PM, RAHUL SURESH <drrahulsuresh at gmail.com>
wrote:

> Dear All,
>
> To deduce the the stability of ligand and protein binding, I would like to
> carry out torsion analysis. How is it possible using Gromacs?
>
> Thanks in advance
> --
> *Regards,*
> *Rahul Suresh*
> *Research Scholar*
> *Bharathiar University*
> *Coimbatore*
> --
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