[gmx-users] water permeation -using GROMACS

[Chandan Choudhury]

Hi Nikhil,

I had written a code for this analysis. You can find its reference at
http://pubs.acs.org/doi/abs/10.1021/bm4011408

Chandan

On Tue, Jul 19, 2016 at 5:52 AM, Nikhil Maroli <scinikhil at gmail.com> wrote:

> Dear all,
>
> How can one calculate the number of water/ion molecules passing per unit
> time for ion channels in the lipid bilayer (for studying water
> permeations).Most of the literature is based on NAMD.
> what is the possibility in GROMACS?
>
>
> --
> Regards,
> Nikhil Maroli
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-- 

Chandan Kumar Choudhury
Post Doctoral Fellow
Clemson University
South Carolina
USA

*"All work and no play makes Jack a dull boy...”*