Hi,
You want the 'radgyr' command. Please refer to the AmberTools manual section
6.5 (pg.120) for details.
On Mon, May 24, 2010 at 2:30 PM, Jayalakshmi Sridhar <jsridhar.xula.edu>wrote:
> Dear Amber users,
> I would like to measure the radius of gyration of an MD simulation. Is it
> possible to do this using ptraj? What command should I use to get this info?
> Thanks for the help.
> Jaya.
>
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Daniel R. Roe
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SAS - Chemistry & Chemical Biology
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Received on Mon May 24 2010 - 19:00:03 PDT
