QM/MM-MD analysis of dissociation of Ag+ and H+ mediated cytidines

P. N. Kliev, Z. V. Reveguk, P. A. Sokolov +2

We report a biased QM/MM molecular dynamics study of the dissociation process of cytidine-cytidine complexes mediated by Ag+ or H+ ions. We performed calculations under real solven…