Toward Quantitatively Accurate Calculation of the Redox-Associated Acid-Base and Ligand Binding Equilibria of Aquacobalamin. [electronic resource]
- The journal of physical chemistry. B 08 2016
- 7307-18 p. digital
Publication Type: Journal Article; Research Support, U.S. Gov't, Non-P.H.S.
1520-5207
10.1021/acs.jpcb.6b02701 doi
Kinetics Ligands Models, Molecular Oxidation-Reduction Quantum Theory Thermodynamics Vitamin B 12--analogs & derivatives Water--chemistry