> > Hi, everyone > > I have run the 3x3x0.8 water film in 3x3x9 box successful.
It is a time for me to proudly ask: "Was i right before?" ... > However, I'd like to add polarization to my water model. Because if i want to > investigate solution interface, the ordinary water model cannot reproduce the > interface properties well. > > How can i add polarization water model to Gromacs? do i need to modify the > .mdp paremeter? You should modify topology file. See SW.ITP in the standard gromacs topology folder as an example. Or if you're lazy, just use this water model for your study... I am not sure that polarizable waters are always better to simulate "interface properties" than conventional ones. Dr. Vitaly V. Chaban Rochester, U.S.A. -- 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
