30 citations · 30 across the 2 of their papers we have counts for
2 papers
q-bio.BM2017
The Activation Entropy Change in Enzymatic Reaction Catalyzed by Isochorismate-Pyruvate Lyase of Pseudomonas Aeruginosa PchB
Liangxu Xie, Zhe-Ning Chen, Mingjun Yang
The elucidation of entropic contribution to enzyme catalysis has been debated over decades. The recent experimentally measured activation enthalpy and entropy, for chorismate rearr…
stat.ME2013★ 30 cited
Combine Umbrella Sampling with Integrated Tempering Method for Efficient and Accurate Calculation of Free Energy Changes of Complex Energy Surface
Mingjun Yang, Lijiang Yang, Yiqin Gao +1
Umbrella sampling is an efficient method for the calculation of free energy changes of a system along well-defined reaction coordinates. However, when multiple parallel channels al…