VMD-L Mailing List
From: John Stone (johns_at_ks.uiuc.edu)
Date: Tue Sep 28 2010 - 10:53:46 CDT
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Hi,
You could try using the "measure sasa" command in an analysis
script to get what you're looking for. See the VMD User's Guide for
more details.
Cheers,
John Stone
vmd_at_ks.uiuc.edu
On Tue, Sep 28, 2010 at 03:24:14PM +0530, hirdesh kumar wrote:
> Hi All,
> I am interested in calculating the change in solvent accessible surface
> area during MD simulation for protein of my interest. Is there any option
> for the same in vmd? I have .parm7 and .crd files as the output files with
> me.
>
> Hirdesh
-- NIH Resource for Macromolecular Modeling and Bioinformatics Beckman Institute for Advanced Science and Technology University of Illinois, 405 N. Mathews Ave, Urbana, IL 61801 Email: johns_at_ks.uiuc.edu Phone: 217-244-3349 WWW: http://www.ks.uiuc.edu/~johns/ Fax: 217-244-6078
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