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浙江工业大学理学院导师教师师资介绍简介-王宪位

本站小编 Free考研考试/2021-04-10


王宪位,浙江工业大学理学院讲师,2014年6月博士毕业于华东师范大学精密光谱科学与技术国家重点实验实验,后进入浙江工业大学工作。
主持完成国家自然科学基金项目两项,浙江省自然科学基金项目一项:
1.国家自然科学基金青年项目,**,蛋白酶设计的量子理论研究,2018/01-2020/12,21万,已结题,主持
2.浙江省自然科学基金一般项目,LY17B030008,分块量子化学方法在蛋白酶设计中的应用,2017/01-2019/12,8万,已结题,主持
3.国家自然科学基金理论物理博士启动基金,**,蛋白质静电性质及振动斯塔克光谱的量子理论计算研究,2016/01-2016/12,6万,已结题,主持
发表SCI论文20余篇,代表性论著如下:
(1)Xianwei Wang*,Jinhua Yan, Hang Zhang, Zhousu Xu, John Z. H. Zhang*, An electrostatic energy-based charge model for molecular dynamics simulation, Journal of Chemical Physics, 2021 accepted.
(2)Xianwei Wang*,Chenhui Lu, Maoyou Yang*, The Impact of Electron Correlation on Describing QM/MM Interactions in the Attendant Molecular Dynamics Simulations of CO in Myoglobin. Scientific reports,2020, 10, 8539.
(3)Xianwei Wang, Xiao He*, An Ab Initio QM/MM Study of the Electrostatic Contribution to Catalysis in the Active Site of Ketosteroid Isomerase.Molecules, 2018,23,2410.
(4)Xianwei Wang*,Yang Li.,YaGao, Zejin Yang, Chenghui Lu,Tong Zhu*, A quantum mechanical computational method for modeling electrostatic and solvation effects of protein.Scientific reports,2018, 8(1), 5475.
(5)Xianwei Wang, John Z.H. Zhang, Xiao He*, Ab initio quantum mechanics/molecular mechanics molecular dynamics simulation of co in the heme distal pocket of myoglobin, Chinese Journal of Chemical Physics, 2017, 30(6): 705-716
(6)Xianwei Wang, John Z. H. Zhang, Xiao He*, Quantum mechanical calculation of electric fields and vibrational Stark shifts at active site of human aldose reductase, Journal of Chemical Physics, 2015, 143(18):184111






教师简介
王宪位
王宪位,浙江工业大学理学院讲师,2014年6月博士毕业于华东师范大学精密光谱科学与技术国家重点实验实验,后进入浙江工业大学工作。
主持完成国家自然科学基金项目两项,浙江省自然科学基金项目一项:
1.国家自然科学基金青年项目,**,蛋白酶设计的量子理论研究,2018/01-2020/12,21万,已结题,主持
2.浙江省自然科学基金一般项目,LY17B030008,分块量子化学方法在蛋白酶设计中的应用,2017/01-2019/12,8万,已结题,主持
3.国家自然科学基金理论物理博士启动基金,**,蛋白质静电性质及振动斯塔克光谱的量子理论计算研究,2016/01-2016/12,6万,已结题,主持
发表SCI论文20余篇,代表性论著如下:
(1)Xianwei Wang*,Jinhua Yan, Hang Zhang, Zhousu Xu, John Z. H. Zhang*, An electrostatic energy-based charge model for molecular dynamics simulation, Journal of Chemical Physics, 2021 accepted.
(2)Xianwei Wang*,Chenhui Lu, Maoyou Yang*, The Impact of Electron Correlation on Describing QM/MM Interactions in the Attendant Molecular Dynamics Simulations of CO in Myoglobin. Scientific reports,2020, 10, 8539.
(3)Xianwei Wang, Xiao He*, An Ab Initio QM/MM Study of the Electrostatic Contribution to Catalysis in the Active Site of Ketosteroid Isomerase.Molecules, 2018,23,2410.
(4)Xianwei Wang*,Yang Li.,YaGao, Zejin Yang, Chenghui Lu,Tong Zhu*, A quantum mechanical computational method for modeling electrostatic and solvation effects of protein.Scientific reports,2018, 8(1), 5475.
(5)Xianwei Wang, John Z.H. Zhang, Xiao He*, Ab initio quantum mechanics/molecular mechanics molecular dynamics simulation of co in the heme distal pocket of myoglobin, Chinese Journal of Chemical Physics, 2017, 30(6): 705-716
(6)Xianwei Wang, John Z. H. Zhang, Xiao He*, Quantum mechanical calculation of electric fields and vibrational Stark shifts at active site of human aldose reductase, Journal of Chemical Physics, 2015, 143(18):184111


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