[gmx-users] Autocorrelation

David spoel at xray.bmc.uu.se
Tue Aug 9 08:22:10 CEST 2005


On Mon, 2005-08-08 at 16:41 -0600, Anthony Cruz wrote:
> Hi Users:
> I am interested in calculate the autocorrelation function of my protein 
> trajectory (position). There is a gromacs tool that do it???
Not really, but you can study diffusion with g_msd.

> 
> Best regard
> Anthony
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,          75124 Uppsala, Sweden
phone:  46 18 471 4205          fax: 46 18 511 755
spoel at xray.bmc.uu.se    spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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