Albert <mailmd2...@gmail.com> wrote: >Dear all: > > As we know that many membrane has a membrane potential with typical >range from -40mV to 80mV. I am just wondering is it possible to add >voltage for membrane protein simulation in Gromacs? If yes, and how? I >go through the .mdp documentation and don't find anything concerning on > >this. > >THX >Albert >-- >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
you will have to decide what voltage across the membrane means and how it is maintained in reality and then decide whether it is important or not to your system and how simplified a model is acceptable for you. the manual suggests there is code to apply a constant electric field to the system. -- Sent from my Android phone with K-9 Mail. Please excuse my brevity. -- 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
