Use NDX file. Dr. Vitaly V. Chaban
> > in my system, there are pr, dna, water and Na and I want to obtain diffusion > of pr in dna but when I use g_msd command, gromacs says select only 1 > group. should be this group pr or dna? > -- 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
