Dear gromacs users, I want to do Gibbs Free energy calculations. In my case their are two molecule in PDB file. I have generated topology file by TopolGen-1.1. Now got the error like Syntax error - File structure.top, line 10 Last line read: '[ moleculetype ]' Invalid order for directive moleculetype. I tried a lot to solve this but as per my understanding i have to include both molecule in couple-moltype in .mdp but in principle it is not possible by relevant site. How i can solve this error. Any help will highly be appreciated
With regards Anjali Patel Research Scholar Department of Physics The M S University of Baroda, Vadodara-390002 -- 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.