Interpretation of pH-activity profiles for acid-base catalysis from molecular simulations.

Dissanayake, Thakshila

Interpretation of pH-activity profiles for acid-base catalysis from molecular simulations. [electronic resource] - Biochemistry Feb 2015 - 1307-13 p. digital

Publication Type: Journal Article; Research Support, N.I.H., Extramural; Research Support, U.S. Gov't, Non-P.H.S.

1520-4995

10.1021/bi5012833 doi


Acid-Base Equilibrium
Catalysis
Hydrogen-Ion Concentration
Molecular Dynamics Simulation