Dea GROMACS Users, I want to calculate the free energy for my system, for example (Gibbs and Helmholtz), but I didn't define the free_energy in the md.mdp and my simulation has been finished!!!
May I ask you that say me is there a solution fro this problem? Best Regards Sara -- gmx-users mailing list gmx-users@gromacs.org 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 gmx-users-requ...@gromacs.org. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
