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浏览/检索结果: 共14条，第1-10条 帮助 限定条件 学科主题：物理化学     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 Beam energy distribution influences on density modulation efficiency in seeded free-electron lasers 期刊论文 physical review special topics-accelerators and beams, 2015, 卷号: 18, 期号: 6, 页码: 060701 作者:  Wang, Guanglei;  Zhang, Weiqing;  Wu, Guorong;  Dai, Dongxu;  Yang, Xueming 收藏  |  浏览/下载：18/0  |  提交时间：2015/11/16 3-Acyl-5-hydroxybenzofuran derivatives as potential anti-estrogen breast cancer agents: A combined experimental and theoretical investigation 期刊论文 bioorganic & medicinal chemistry letters, 2013, 卷号: 23, 期号: 16, 页码: 4617-4621 作者:  Li, Xiao-Yan;  He, Bi-Feng;  Luo, Hua-Jun;  Huang, Nian-Yu;  Deng, Wei-Qiao 收藏  |  浏览/下载：31/0  |  提交时间：2014/09/11 3-Acyl-5-hydroxybenzofuran  Breast cancer  Estrogen receptor alpha (ER alpha)  Quantum Mechanics Polarized Ligand Docking (QPLD)   Towards understanding the solution dynamics using the combination of computer simulation and spectroscopy 会议论文 asia-pacific conference of theoretical and computational chemistry, 庆州, 2013-7-10 张强; 张睿挺; 吴天敏; 庄巍 收藏  |  浏览/下载：12/0  |  提交时间：2013/10/10 Theoretical study on the structures and properties of mixtures of urea and choline chloride 期刊论文 journal of molecular modeling, 2013, 卷号: 19, 期号: 6, 页码: 2433-2441 作者:  Sun, Hui;  Li, Yan;  Wu, Xue;  Li, Guohui 收藏  |  浏览/下载：13/0  |  提交时间：2014/09/11 Deep eutectic solvent  Dynamic structure  Property  Molecular dynamic simulation   Exploring the Relationship between Sequences, Structures, Dynamical Behaviors and Functions of New Type Protein Drugs: DARPins 期刊论文 current pharmaceutical design, 2013, 卷号: 19, 期号: 12, 页码: 2308-2317 作者:  Wu, Xue;  Shi, Yue;  Ren, Pengyu;  Wang, Deping;  Li, Guohui 收藏  |  浏览/下载：20/0  |  提交时间：2014/09/11 Molecular dynamics simulation DARPins protein drug  dynamical cross correlation stability   Investigating the Structural Origin of Trpzip2 Temperature Dependent Unfolding Fluorescence Line Shape Based on a Markov State Model Simulation 期刊论文 journal of physical chemistry b, 2012, 卷号: 116, 期号: 42, 页码: 12669-12676 作者:  Song, Jian;  Gao, Fang;  Cui, Raymond Z.;  Shuang, Feng;  Liang, Wanzhen 收藏  |  浏览/下载：14/0  |  提交时间：2013/10/11 Hollow fiber-based liquid-liquid-liquid micro-extraction with osmosis: I. Theoretical simulation and verification 期刊论文 journal of chromatography a, 2012, 卷号: 1248, 页码: 32-40 作者:  Wu, Qian;  Wu, Dapeng;  Geng, Xuhui;  Shen, Zheng;  Guan, Yafeng 收藏  |  浏览/下载：13/0  |  提交时间：2013/10/11 Hollow fiber-based liquid-liquid-liquid micro-extraction  Osmosis  Mass transfer kinetic model   Identification of Novel Potential beta-N-Acetyl-D-Hexosaminidase Inhibitors by Virtual Screening, Molecular Dynamics Simulation and MM-PBSA Calculations 期刊论文 international journal of molecular sciences, 2012, 卷号: 13, 期号: 4, 页码: 4545-4563 作者:  Liu, Jianling;  Liu, Mengmeng;  Yao, Yao;  Wang, Jinan;  Li, Yan 收藏  |  浏览/下载：25/0  |  提交时间：2013/10/11 beta-N-acetyl-D-hexosaminidase  OfHex1  inhibitor  virtual screening  molecular dynamics  MM/PBSA   A computational analysis of interaction mechanisms of peptide and non-peptide inhibitors with MDMX based on molecular dynamics simulation 期刊论文 computational and theoretical chemistry, 2012, 卷号: 984, 页码: 43-50 作者:  Cheng, Wei-yuan;  Chen, Jian-zhong;  Liang, Zhi-qiang;  Li, Guo-hui;  Yi, Chang-hong 收藏  |  浏览/下载：12/0  |  提交时间：2013/10/11 MD simulation  Computational alanine scanning  MM-GBSA method  p53-MDMX interaction  Cross correlation analysis   Li+ ionic conductivities and diffusion mechanisms in Li-based imides and lithium amide 期刊论文 physical chemistry chemical physics, 2012, 卷号: 14, 期号: 5, 页码: 1596-1606 作者:  Li, Wen;  Wu, Guotao;  Xiong, Zhitao;  Feng, Yuan Ping;  Chen, Ping 收藏  |  浏览/下载：28/0  |  提交时间：2013/10/11