Xia Mu

QM/MM investigation of substrate binding of subclass B3 metallo-β-lactamase SMB-1 from Serratia marcescents: insights into catalytic mechanism

Dingguo Xu, Xia Mu, 2020, Journal of Molecular Modeling.

QM/MM investigation of the catalytic mechanism of angiotensin-converting enzyme

Dingguo Xu, Xia Mu, Chunchun Zhang, 2016, Journal of Molecular Modeling.

Solvent‐dependent gas‐driven fabrication of shape-controlled silica: insights into the active sites and catalytic mechanism of silica-catalyzed Baeyer-Villiger reaction

Sha Luo, Jiantai Ma, Xia Mu, 2022, Molecular Catalysis.

QM/MM Molecular Dynamics Investigations of the Substrate Binding of Leucotriene A4 Hydrolase: Implication for the Catalytic Mechanism.

Dingguo Xu, Xia Mu, 2018, The journal of physical chemistry. B.