Hello Gromacs users, I'm using a Buckingham potential for the nonbonded interactions in my system, so I have the following lines in my forcefield.itp file:
[ defaults ] ; nbfunc comb-rule gen-pairs fudgeLJ fudgeQQ 2 1 no 1.0 1.0 -- Olivia Waring (王维娅) Princeton University '12 AB Chemistry
-- 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