Citation:
X. Lu, D. Fang, S. Ito, Y. Okamoto, V. Ovchinnikov, and Q. Cui. 2016. “QM/MM free energy simulations: recent progress and challenges.” Mol. Sim., 42, Pp. 1052-1078.
Karplus group
Computational Chemistry and Biophysics Laboratory
Department of Chemistry and Chemical Biology
Harvard University
