>> Hi, everyone >> >> I have two simulations which could run well separately. Now I want to place >> the box of simulation A onto the box of simulation B. What should I do to >> realise that? >> >> I've tried to copy and paste the .gro and .top file together, but there are >> several mistakes in grompp. I wonder if there are some better method to >> merge 2 simulation boxes.
You probably have duplicate entries in the topollogy file. Remove the unnecessary ones... -- Dr. Vitaly Chaban http://chaban.at.ua -- 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
