wuxiao wrote: > Dear GMXers, > I want to calculate the inter- and intra-molecular radial distribution > functions (rdfs), separately. However, I find the g_rdf routine can only > be useful to calculate the total rdf. Is there any similar routine which > can be used to reach my aim? Please give me some hints. Thanks a lot for > your reply.
Did you start with reading g_rdf -h to see what it had to say? Mark _______________________________________________ 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
