Hi All, Can anyone help me regarding the -sigfac option in gmx sigeps? What does this -sigfac mean? And, is the C6, C9 terms correspond to the C6, C9 terms in the ffnonbonded.itp? I am using the LJ potential form, U(r) = (27/4)*epsilon [ (sigma/r)^9 - (sigma/r)^6 ]
any help would be appreciated -- Tamisra Pal Post Doctoral Research Fellow Technische Universität Darmstadt Institut für Festkörperphysik Hochschulstraße 6 64289 Darmstadt , Germany <callto:+496151165569> -- 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 [email protected].
