Hi, Check out the modified g_covar version with correlations, which is on the user contributions. Ran.
sheerychen wrote: > Hello, everyone, > > Do anybody knows how to calculate the scalar correlation > matrix across the alpha carbon atoms, where the correlation function > is defined as: Cij=<delta_ri*delta_rj>/squart(<delta_ri^2><delta_rj^2>). > Is there any direct command can do this in gromacs? Thanks. > // > // > ------------------------------------------------------------------------ > > _______________________________________________ > gmx-users mailing list [email protected] > http://lists.gromacs.org/mailman/listinfo/gmx-users > Please search the archive at http://www.gromacs.org/search before posting! > Please don't post (un)subscribe requests to the list. Use the > www interface or send it to [email protected]. > Can't post? Read http://www.gromacs.org/mailing_lists/users.php
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