Hi all! It might be a silly question, but I am wondering why explicit hydrogens do not have LJ parameters in Gromos forcefields (they are set 0), while HC hydrogens (aromatic) has some value:
;name at.num mass charge ptype c6 c12 HC 1 0.000 0.000 A 8.464e-05 1.5129e-08 H 1 0.000 0.000 A 0 0 Best regards, -- Marcelo Depólo Polêto Group of Structural Bioinformatics - Center of Biotechnology Student of MSc Cell and Molecular Biology - UFRGS (Brazil) B.Sc. Biochemistry - University of Viçosa (Brazil) -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.