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匡国柱

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Professor Supervisor of Master's Candidates

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Shijun Zhong.Covalent bond-contained intermolecular interaction between TB BlaC and carbapenems[A],The 15th International Congress of Quantum Chemistry,2022
zhaodan, Shijun Zhong.Binding mechanisms of varic acid inhibitors on protein tyrosine phosphatase 1B and in silico design of the novel derivatives[J],MOLECULAR SIMULATION,2022,47(9):771-784
chuyuzhuo, Sun, Lu, Shijun Zhong.How Y357F, Y276F mutants affect the methylation activity of PRDM9: QM/MM MD and free energy simulations[J],JOURNAL OF MOLECULAR MODELING,2022,21(5):125
Sun, Lu, Fan, Hongjun, Shijun Zhong.Evaluating the covalent binding of carbapenems on BlaC using noncovalent[J],Journal of molecular modeling,2022,27(6):161
Sun, Lu, Fu, Tingting, zhaodan, Fan, Hongjun, Shijun Zhong.Divide-and-link peptide docking: a fragment-based peptide docking protocol[J],PHYSICAL CHEMISTRY CHEMICAL PHYSICS,2022,23(39):22647-22660
zhaodan, Sun, Lu, Shijun Zhong.Discovery of inhibitors targeting protein tyrosine phosphatase 1B using a combined virtual screening approach[J],MOLECULAR DIVERSITY,2022

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