[gmx-users] cumulative velocity correlation

David van der Spoel spoel at xray.bmc.uu.se
Wed Jun 4 08:34:57 CEST 2008


Collins Nganou wrote:
> Dear gmx-Users,
> 
>       Greetings.  Please someone can tell me how to run
> 
>      cumulative velocity correlation with gromacs
> 
>       and perform Fourier spectral analysis
> 
>        of the cumulative velocity correlation function
Sorry what is that?
You can do autocorrelation with g_velacc and do spectral analysis of the 
results using e.g. xmgrace.
> 
> 
>   Thanks to all response.
> 
> 
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-- 
David van der Spoel, Ph.D., Professor of Biology
Molec. Biophys. group, Dept. of Cell & Molec. Biol., Uppsala University.
Box 596, 75124 Uppsala, Sweden. Phone:	+46184714205. Fax: +4618511755.
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se



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