[gmx-users] to study native cluster

Tsjerk Wassenaar tsjerkw at gmail.com
Mon Nov 18 20:54:52 CET 2013


Hey,

Maybe this is useful:
http://md.chem.rug.nl/~mdcourse/molmod2012/analysis.html

Hope it helps,

Tsjerk


On Mon, Nov 18, 2013 at 6:56 PM, Shine A <shine.a at iisertvm.ac.in> wrote:

> Sir,
>  I did an MD simulation.Now I want to combine the techniques, principal
> component (PC) analysis
> and clustering, for revealing major conformational changes in my protein
> and for finding native cluster. How can I do this in gromacs?
>
>                                         Thanks in
> advance.......................
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-- 
Tsjerk A. Wassenaar, Ph.D.


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