Jianzhong
www.mendeley.com
0000-0003-1558-4398
Shandong Jiaotong University
7 papers found
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Deciphering molecular mechanism behind conformational change of the São Paolo metallo-β-lactamase 1 by using enhanced sampling
Molecular Mechanism of Binding Selectivity of Inhibitors toward BACE1 and BACE2 Revealed by Multiple Short Molecular Dynamics Simulations and Free Energy Predictions
Understanding the selectivity of inhibitors toward PI4KIIIα and PI4KIIIβ based molecular modeling
Exploring molecular mechanism of allosteric inhibitor to relieve drug resistance of multiple mutations in HIV‐1 protease by enhanced conformational sampling
Inhibiting mechanism of small molecule toward the p53-MDM2 interaction: A molecular dynamic exploration
Dynamics revelation of conformational changes and binding modes of heat shock protein 90 induced by inhibitor associations
Mutation L1196M-induced conformational changes and the drug resistant mechanism of anaplastic lymphoma kinase studied by free energy perturbation and umbrella sampling
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