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Molecular insights into the dispersibility of asphaltene and crude oil rheological properties under the effect of multi-alkylated aromatic amides 期刊论文
CHEMICAL ENGINEERING SCIENCE, 2024, 卷号: 285, 页码: 12
作者:  Zhu, Bojin;  Li, Zhen;  Han, Tiankun;  Yan, Youguo;  Li, Jiawei
收藏  |  浏览/下载:2/0  |  提交时间:2024/04/07
Insights into the effect of water content on asphaltene aggregation behavior and crude oil rheology: A molecular dynamics simulation study 期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2024, 卷号: 396, 页码: 9
作者:  Zhu, Bojin;  Yang, Menglong;  Yan, Youguo;  Zhong, Jie;  Li, Jiawei
收藏  |  浏览/下载:1/0  |  提交时间:2024/04/07
NMR Structure and Dynamics Studies of Yeast Respiratory Supercomplex Factor 2 期刊论文
STRUCTURE, 2021, 卷号: 29
作者:  Zhou, Shu;  Pettersson, Pontus;  Huang, Jingjing;  Brzezinski, Peter;  Pomes, Regis
收藏  |  浏览/下载:22/0  |  提交时间:2021/05/06
Exploration of Fragment Binding Poses Leading to Efficient Discovery of Highly Potent and Orally Effective Inhibitors of FABP4 for Anti-inflammation 期刊论文
JOURNAL OF MEDICINAL CHEMISTRY, 2020, 卷号: 63, 期号: 8, 页码: 4090-4106
作者:  Su, Haixia;  Zou, Yi;  Chen, Guofeng;  Dou, Huixia;  Xie, Hang
收藏  |  浏览/下载:32/0  |  提交时间:2020/07/01
DNA Framework-Encoded Mineralization of Calcium Phosphate 期刊论文
CHEM, 2020, 卷号: 6, 期号: 2, 页码: 472-485
作者:  Liu, XG;  Jing, XX;  Liu, P;  Pan, MC;  Liu, Z
收藏  |  浏览/下载:19/0  |  提交时间:2021/09/06
Deciphering molecular mechanism behind conformational change of the Sao Paolo metallo-beta-lactamase 1 by using enhanced sampling 期刊论文
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2019, 页码: 12
作者:  Chen, Jianzhong;  Wang, Jinan;  Pang, Laixue;  Wang, Wei;  Zhao, Juan
收藏  |  浏览/下载:47/0  |  提交时间:2020/07/01
Effects of the Water Content on the Transport Properties of Ionic Liquids 期刊论文
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2019, 卷号: 58, 期号: 42, 页码: 19661-19669
作者:  Guo, Shuai;  Chen, Fan;  Liu, Lei;  Li, Yao;  Liu, Xiaomin
收藏  |  浏览/下载:19/0  |  提交时间:2020/03/24
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
Exploring binding mechanisms of VEGFR2 with three drugs lenvatinib, sorafenib, and sunitinib by molecular dynamics simulation and free energy calculation 期刊论文
CHEMICAL BIOLOGY & DRUG DESIGN, 2019, 卷号: 93, 期号: 5, 页码: 934-948
作者:  Wang, Yu;  Peng, Cheng;  Wang, Guimin;  Xu, Zhijian;  Luo, Yongfeng
收藏  |  浏览/下载:16/0  |  提交时间:2020/07/01
Separation Efficiency of CO2 in Ionic Liquids/Poly(vinylidene fluoride) Composite Membrane: A Molecular Dynamics Study 期刊论文
INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH, 2019, 卷号: 58, 期号: 16, 页码: 6887-6898
作者:  Song, Tao;  Zhang, Xiaochun;  Li, Yonggang;  Jiang, Kun;  Zhang, Suojiang
收藏  |  浏览/下载:39/0  |  提交时间:2019/06/14


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