Dear all, I am trying to create a topology for a molecule using g_x2top and have defined all the atoms with connectivity in *atomname.n2t* file with different opls no. for all different types of atoms.
But when I create topology, it does not identify all different atomtypes and takes one common opls no. for some of the atoms. Thanks Rakesh -- 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].
