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浏览/检索结果: 共5条，第1-5条 帮助 限定条件 专题：华中师范大学    第一署名单位    第一作者单位    通讯作者单位     已选(0)清除 条数/页：5101520253035404550556065707580859095100   排序方式：请选择作者升序作者降序题名升序题名降序发表日期升序发表日期降序提交时间升序提交时间降序 Accurate estimation of electrostatic binding energy with Poisson-Boltzmann equation solver DelPhi program 期刊论文 Journal of Theoretical and Computational Chemistry, 2016, 卷号: 15, 期号: 8 作者:  Li, Anbang*;  Gao, Kaifu 收藏  |  浏览/下载：6/0  |  提交时间：2019/12/23 Electrostatic interactions  poisson-boltzmann equation  delPhi program  electrostatic binding free energy   Computational and Experimental Insights into the Mechanism of Substrate Recognition and Feedback Inhibition of Protoporphyrinogen Oxidase 期刊论文 PLOS ONE, 2013, 卷号: 8, 期号: 7, 页码: e69198 作者:  Hao, Ge-Fei;  Tan, Ying;  Yang, Sheng-Gang;  Wang, Zhi-Fang;  Zhan, Chang-Guo* 收藏  |  浏览/下载：7/0  |  提交时间：2019/12/23 Free energy,Hydrogen bonding,Oxygen,Biochemical simulations,Enzyme kinetics,Binding analysis,Enzyme inhibitors,Enzymes   Computational gibberellin-binding channel discovery unraveling the unexpected perception mechanism of hormone signal by gibberellin receptor 期刊论文 Journal of Computational Chemistry, 2013, 卷号: 34, 期号: 24, 页码: 2055-2064 作者:  Hao, Ge-Fei*;  Yang, Sheng-Gang;  Yang, Guang-Fu;  Zhan, Chang-Guo 收藏  |  浏览/下载：4/0  |  提交时间：2019/12/23 binding free energy  gibberellin  hormone perception mechanism  plant hormone  protein-ligand interaction   A Comparative Study of Drug Resistance Mechanism Associated with Active Site and Non-Active Site Mutations: I388N and D425G Mutants of Acetyl-Coenzyme-A Carboxylase 期刊论文 Current Computer - Aided Drug Design, 2012, 卷号: 8, 期号: 1, 页码: 62-69 作者:  Zhu, Xiao-Lei;  Yang, Guang-Fu* 收藏  |  浏览/下载：2/0  |  提交时间：2019/12/23 Acetyl-CoA carboxylase  MD simulations  binding affinity  binding free energy  computational simulations  linear correlation  molecular dynamics  molecular mechanics-Poisson-Boltzmann surface area (MM/PBSA) calculations  resistance mechanism  wild-type enzyme   Search for weakly bound states of the He-He-Be triatomic system 期刊论文 Physical Review A - Atomic, Molecular, and Optical Physics, 2009, 卷号: 79, 期号: 2 作者:  Li, Yong*;  Song, Hongwei;  Gou, Qingdong;  Han, Huili;  Shi, Tingyun 收藏  |  浏览/下载：2/0  |  提交时间：2019/12/23 beryllium  binding energy  bound states  helium  Schrodinger equation