Dear Gromacs Experts, I am working with fluorescent protein, posesing a chromophore which I defined as a non-standard " amino-acid residue". Now, I want to use Charmm22 force field and the issue is that I am missing CMAP parameters and these are not available in the literature.
My question is, whether there is a way to use CMAP parameters only for connection between standard a.a. and omit them for connection between my chromophore and standard a.a.? Best wishes, Dawid Grabarek -- 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.
