[gmx-users] g-C3N4 GROMOS parameters

Morten morten at slyngborg.com
Mon Dec 5 17:13:37 CET 2016


anyone got an idea of the best way to parameterize a g-C3N4 structure 
for the GROMOS force field? I am not sure if PRODRG will be useful as it 
is difficult to find properties to parameterize after. Any applicable 
literature is welcome :)

Best regards

More information about the gromacs.org_gmx-users mailing list