Dear gmx user I am working on protein ionic liquid interaction. I am trying to calculate the binding free energy of ionic liquid (system contain ~ 100 ionic liquid molecule). Is there any way to calculate the binding free energy in pre processing stage of post processing stage. ******************************************************
*Krishna Prasad GhantaResearch Scholar* *Molecular Modeling Laboratory* *Indian Institute Of Technology Kharagpur* *Kharagpur-721302Contact no - 8327297650* *************************************** -- 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.
