Dear Gromacs Users!
I want to perform my simulation under conditions with collisional thermostat (where each atom is bombarded by virtual particles with Maxwell speed distribution) instead of thermostat with alternate friction ( like Nose Hoover which I'm using after my system have been equilibrated with berendsen thermostat ). As I've understood for such simulation I should use BD integrator with Langevin's friction inclusion instead of leaf frog MD. Doest this correct? Also I wounder to know what t_couple value should I use for such simulation in NVT conditions ? ( I'm simulating membrane protein system). Thanks for help James -- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users * Only plain text messages are allowed! * 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
