Dear gmx users, How can I calculate the distance between the central of mass of two groups ( for example: ligand and protein)? As far as I understand gmx mindist does not do it.
And is that possible to calculate the distance per residue as a function of time? I would like to calculate the distance between ligand and each residue as a function of time. Cheers, -- Qasim Pars -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
