Hi Mark, Thank you for your reply.
I want to implement this wacky idea because a part of the potential of the system needs to be input in a tabulated form (referring to Iterative Boltzmann Inversion) and the other part (solvent-solvent) interaction is defined by sigma and epsilon, which I again input in the form of a table since GROMACS does not support both tabulated and non-tabulated at the same time. So, then, am I right to understand that eqn 4.28 of manual-5.1 is the functional form of potential of the force-switch method, and that there is no documentation provided for potential-switch? Many thanks! -Pallavi Banerjee -- 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.
