姓名:张志扬
毕业院校:河南大学
电子邮箱:zhzy93@163.com
研究方向: 计算化学,计算生物学
量子力学-经典力学组合方法与生物相关体系计算模拟
酶催化反应机理计算模拟
配体输运通道理论计算模拟
理论实验结合的药物筛选与结构改造
学术论文:
1. Fang D#, Zhang Z#, Zhai J, Guo B, Li P, Liu X, Song J, Xie S, Wu R, Zhao Y*, Wang C*. Enzymatic-related network of catalysis, polyamine, and tumors for acetylpolyamine oxidase: from calculation to experiment. Chem. Sci., 2024,15, 2867-2882.
2. Zhang Z, Lv J, Wang Y, Yu H, Guo B, Zhai J, Wang C, Zhao Y*, Fan F*, Luo W*. Static Binding and Dynamic Transporting-Based Design of Specific Ring-Chain-Ring Acetylcholinesterase Inhibitor: From Galantamine to Natural Product. Chem. Eur. J., 2023, 29, e202203363.
3. Zhang Z#, Fan F#, Luo W, Zhao Y*, Wang C*. Molecular Dynamics Revealing a Detour-Forward Release Mechanism of Tacrine: Implication for the Specific Binding Characteristics in Butyrylcholinesterase. Front. Chem., 2020, 8, 730.
4. Zhai J, Fan F, Wang C, Zhang Z*, Zhang S*, Zhao Y*. Molecular Dynamics Study on the Binding Characteristics and Transport Mechanism of Polysaccharides with Different Molecular Weights in Camellia Oleifera Abel. J. Comput. Biophys. Chem., 2024; 23(03): 367-377.