Hi, all, I am still trying to do my simulation with liquid mixtures.
I have a simple question now. When I writing my .top file, how could I know if I should use epsilon-sigma or c6-c12 parameters for the LJ potential? It seems that in some examples, c6-c12 parameters are used and epsilon-sigma parameters are used in some other examples. Thank you very much. Best Regards, Kai -- gmx-users mailing list [email protected] http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/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/Support/Mailing_Lists
