[gmx-users] Functional dynamics in gromacs

Gustavo Olivos tavolivos at gmail.com
Fri Sep 20 02:37:32 CEST 2019

Dear Users,

I am working in a project, and I need to perform functional dynamics. I
would like to associate local movements in the active sites with important
function of a set of proteins. I wonder if someone have used it before, and
if so, I would bet you to share a tutorial to do it. I used to run
molecular dynamics in gromacs parallel.

Thanks in advance for your support.

Kind regards.

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