Dear all, I'm trying to evaluate the stability of a (bacterio)-chlorophyll docked into my protein active site, but it appears that there is no parameter for this molecule in gromacs force fields and PRODRG does not support Mg atoms.
Does anyone have such parameters ? Cheers. -- MAUPETIT Julien - Plateforme RPBS MTi - Unite Inserm / Paris 7 Diderot U973 Université Paris Diderot Paris 7 Bâtiment Lamarck, 5ème étage unité MTI 36, rue Hélène Brion 75013 Paris FRANCE tel: +33 1 57 27 83 95 http://julien.maupetit.free.fr _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to gmx-users-requ...@gromacs.org. Can't post? Read http://www.gromacs.org/mailing_lists/users.php