>/ Thank you. />/ But i have one last question: />/For epsilon_rf i use the relative permittivity of the medium. I simulate in />/vacuum so epsilon_rf would be 1? /GROMOS ff is not parameterized for vaccum simulations of the b-something version ... have look at the paper.
So i should use ffG43b1 instead of the other GROMOS96 force fields? In the GROMACS manual i found that the cut-off-distance must at least be 1.4 nm for the GROMOS96 force field. So can i use: type = cut-off; rlist = 1.4 and r_x = 1.7? (the problem is that the only reference i find for ffG43b1 is the GROMOS manual, and that's not free avaible) Thanks for an answer Thomas _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to [EMAIL PROTECTED] Can't post? Read http://www.gromacs.org/mailing_lists/users.php
