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Molecular Mechanism of Binding Selectivity of Inhibitors toward BACE1 and BACE2 Revealed by Multiple Short Molecular Dynamics Simulations and Free-Energy Predictions 期刊论文
ACS CHEMICAL NEUROSCIENCE, 2019, 卷号: 10, 期号: 10, 页码: 4303-4318
作者:  Chen, Jianzhong;  Wang, Jinan;  Yin, Baohua;  Pang, Laixue;  Wang, Wei
收藏  |  浏览/下载:114/0  |  提交时间:2020/07/01
In situ 3D topographic and shape analysis by synchrotron radiation X-ray microtomography for crystal form identification in polymorphic mixtures 期刊论文
SCIENTIFIC REPORTS, 2016, 卷号: 6
作者:  Yin, Xian-Zhen;  Xiao, Ti-Qiao;  Nangia, Ashwini;  Yang, Shuo;  Lu, Xiao-Long
收藏  |  浏览/下载:24/0  |  提交时间:2019/01/08
An optimization of the LC-MS/MS workflow for deep proteome profiling on an Orbitrap Fusion 期刊论文
ANALYTICAL METHODS, 2016, 卷号: 8, 期号: 2, 页码: 425-434
作者:  Nie, Litong;  Zhu, Mingrui;  Sun, Shengnan;  Zhai, Linhui;  Wu, Zhixiang
收藏  |  浏览/下载:17/0  |  提交时间:2019/01/08
A comparative study of trypsin specificity based on QM/MM molecular dynamics simulation and QM/MM GBSA calculation 期刊论文
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2015, 卷号: 33, 期号: 12, 页码: 2606-2618
作者:  Chen, Jianzhong;  Wang, Jinan;  Zhang, Qinggang;  Chen, Kaixian;  Zhu, Weiliang
收藏  |  浏览/下载:17/0  |  提交时间:2019/01/08
Identification of 15d-PGJ(2) as an antagonist of farnesoid X receptor: Molecular modeling with biological evaluation 期刊论文
STEROIDS, 2013, 卷号: 78, 期号: 9, 页码: 813-822
作者:  Xu, Xing;  Lul, Yin;  Chen, Lili;  Chen, Jing;  Luo, Xiaomin
收藏  |  浏览/下载:16/0  |  提交时间:2019/01/08
Nanocrystal Preparation: Low-Energy Precipitation Method Revisited 期刊论文
CRYSTAL GROWTH & DESIGN, 2013, 卷号: 13, 期号: 7, 页码: 2766-2777
作者:  Khan, Shahzeb;  de Matas, Marcel;  Zhang, Jiwen;  Anwar, Jamshed
收藏  |  浏览/下载:19/0  |  提交时间:2019/01/08
Dynamic Mechanism of Fatty Acid Transport across Cellular Membranes through FadL: Molecular Dynamics Simulations 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2008, 卷号: 112, 期号: 41, 页码: 13070-13078
作者:  Zou, Hanjun;  Zheng, Mingyue;  Luo, Xiaomin;  Zhu, Weiliang;  Chen, Kaixian
收藏  |  浏览/下载:15/0  |  提交时间:2019/01/08
Pharmacophore-directed homology modeling and molecular dynamics simulation of g protein-coupled receptor: Study of possible binding modes of 5-HT2C receptor Agonists 期刊论文
ACTA BIOCHIMICA ET BIOPHYSICA SINICA, 2007, 卷号: 39, 期号: 6, 页码: 413-422
作者:  Zuo, Zhili;  Chen, Gang;  Luo, Xiaomin;  Puah, Chummok;  Zhu, Weiliang
收藏  |  浏览/下载:54/0  |  提交时间:2019/01/08
Pharmacophore-directed Homology Modeling and Molecular Dynamics Simulation of G Protein-coupled Receptor: Study of Possible Binding Modes of 5-HT_(2C) Receptor Agonists 期刊论文
Acta Biochimica et Biophysica Sinica, 2007, 卷号: 39, 期号: 6, 页码: 413
作者:  Zhili ZUO;  Gang CHEN;  Xiaomin LUO;  Chummok PUAH;  Weiliang ZHU
收藏  |  浏览/下载:12/0  |  提交时间:2020/07/01


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