Interaction Mechanisms of Inhibitors of Glucoamylase by Molecular Dynamics Simulations and Free Energy Calculations
LUO Fang, GAO Jian, CHENG Yuan-Hua, CUI Wei, JI Ming-Juan
Acta Phys. -Chim. Sin. . 2012, (09): 2191 -2201 .  DOI: 10.3866/PKU.WHXB201207063