Hi all Is there a tool to calculate molecular volume for a whole MD trajectory? I.e. I'd like to see how does the molecule changes its volume during MD. I know that there are many external tools for this purpose, but maybe I'm wrong and GROMACS already has something for that? Thanks in advance -- Andrew Gonchar Андрей Гончар -- 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.