Hi, I need to set position restraints on phosphorus head groups of lipids in addition of protein.
In mdp file I added two lines: define = -DPOSRES define= -DPOSRES_LIPID But I get the error that multiple define assignments are not allowed. Is the "define= -DPOSRES_LIPID" is enough for both protein and headgroups? Thanks in advance. Sincerely, Shima -- gmx-users mailing list [email protected] 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 [email protected]. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
