yes. you can use g_energy to plot what you need (T, density or whatever) and decide if it is acceptable or not. In the latter case you simply have to extend your run (see http://www.gromacs.org/Documentation/How-tos/Extending_Simulations)
cheers Francesco On Tue, 7 May 2013, at 06:58 PM, Za Pour wrote: > Dear gmx users > would you please tell me how I can be sure that my simulation time is > long > enough? is it appropriate way to use g_energy program and calculate total > energy ? > thank you > > -- > 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 -- Francesco frac...@myopera.com -- 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
