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[期刊论文] 作者：Xiao He,Guohui Li,Donghui Zhang,
来源：化学物理学报（英文版） 年份：2021
This special issue is dedicated to Professor John Z.H.Zhang for celebrating his 60th birthday.We are...
[会议论文] 作者：John Z.H.Zhang,
来源：The International Conference on Computational and System Bio 年份：2009
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[会议论文] 作者：John Z.H.Zhang,
来源：第十一届全国化学动力学会议 年份：2009
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[会议论文] 作者：John Z.H.Zhang,
来源：2019中国化学会第十五届全国计算(机)化学学术会议 年份：2019
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[会议论文] 作者：John Z.H.Zhang,
来源：数学生物物理及分子生物学研讨会(The Mathematical Biophysics and Molecular Bi 年份：2016
Due to the complex nature of biomolecules,computational studies of inter-action in proteins are primarily based on classical force fields.However,the inhere...
[会议论文] 作者：John Z.H.Zhang,
来源：第四届国际分子模拟大会(The International Conference on Molecular Simula 年份：2016
Efficient and reliable computation of free energy in protein-ligand binding,protein-protein binding etc.is a grand challenge in computational biology and is...
[会议论文] 作者：John Z.H.Zhang,
来源：第十三届全国量子化学会议 年份：2017
The theoretical calculation of protein-protein binding free energy is a grand challenge in computational biology.Accurate prediction of critical residues along...
Force Field Development and Fragment based Ab Initio Molecular Dynamic Simulation for MetalloProtein
[会议论文] 作者：Tong Zhu,John Z.H.Zhang,
来源：第十五届全国化学动力学会议 年份：2017
A polarizable-charge transfer force field(QPCT) has been proposed to accurately describe the interaction dynamics of zinc–protein complexes....
Force Field Development and Fragment based Ab Initio Molecular Dynamic Simulation for MetalloProtein
[会议论文] 作者：Tong Zhu,John Z.H.Zhang,
来源：第十五届全国化学动力学会议 年份：2017
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[会议论文] 作者：Fei Xia,John Z.H.Zhang,
来源：第十二届全国量子化学会议 年份：2014
The guanine nucleotide-binding proteins are responsible for various cellular processes in eukaryotic cells,including heterotrimeric G-proteins and members of Ras-related superfamily.The Ras protein ha...
Ab initio Quantum Mechanics/Molecular Mechanics Molecular Dynamics Simulation of CO in the Heme Dist
[期刊论文] 作者：Xian-wei Wang,John Z.H.Zhang,Xiao He,
来源：黑龙江科技信息 年份：2017
本文通过对荣华二采区10...
[会议论文] 作者：Min Li,John Z.H.Zhang,Fei Xia,
来源：第四届国际分子模拟大会(The International Conference on Molecular Simula 年份：2016
...
[会议论文] 作者：Xiao H.Wang,Zhao X.Sun,John Z.H.Zhang,
来源：第十三届全国量子化学会议 年份：2017
The efficiency of alchemical free energy simulation with staging strategy is improved by adaptively manipulating the significance of each ensemble followed...
[会议论文] 作者：Linqiong Qiu,Jianing Song,John Z.H.Zhang,
来源：第十三届全国量子化学会议 年份：2017
ECF transporters are responsible for many micronutrients uptake in organisms.S component FolT of ECF transporter is recently crystallized and provides solid basis to study the micronutrients binding m...
[会议论文] 作者：Yongxiu Li,John Z.H.Zhang,Ye Mei,
来源：第十二届全国量子化学会议 年份：2014
The explicitly polarized force field model is indispensable in the simulation of protein crystal due to its particular electrostatic environment which is different from that in water solution.The pola...
[会议论文] 作者：Zhao X.Sun,Xiao H.Wang,John Z.H.Zhang,
来源：第十三届全国量子化学会议 年份：2017
The efficiency of alchemical free energy simulation with staging strategy is improved by adaptively manipulating the significance of each ensemble followed by importance sampling....
[会议论文] 作者：Xiao Liu,Yu N.Yan,John Z.H.Zhang,
来源：第十三届全国量子化学会议 年份：2017
The theoretical calculation of protein-ligand binding free energy is a grand challenge in computational biology.Accurate prediction of critical residues along with their specific and quantitative cont...
[会议论文] 作者：林世鹰,韩克利,John Z.H.Zhang,
来源：2000年中国博士后学术大会 年份：2000
利用BLRS势能面首次对O(D)+HCl反应进行了精确的三维含时量子波包计算.反应截面的计算结果与经黄轨线结果符合得很好,反应速率的计算结果与实验结果也符合得非常好....
[会议论文] 作者：林世鹰,韩克利,John Z.H.Zhang,
来源：2000年中国博士后学术大会 年份：2000
利用BLRS势能面首次对O(D)+HCl反应进行了精确的三维含时量子波包计算.反应截面的计算结果与经黄轨线结果符合得很好,反应速率的计算结果与实验结果也符合得非常好....
[会议论文] 作者：Ye Mei,John Z.H.Zhang,Yang Li,Changge Ji,
来源：第十一届全国量子化学会议 年份：2011
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