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浏览/检索结果: 共435条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择提交时间升序提交时间降序发表日期升序发表日期降序题名升序题名降序作者升序作者降序 Exploring the mechanism of the PTP1B inhibitors by molecular dynamics and experimental study 期刊论文  OAI收割 JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2023, 卷号: 125, 页码: 12 作者:  Zhao, Tian-Tian;  Hu, Hao-Jie;  Gao, Li-Xin;  Zhou, Yu-Bo;  Zhu, Yun-Long   |  收藏  |  浏览/下载：11/0  |  提交时间：2023/10/17 Protein tyrosine phosphatases inhibitors  PTP1B inhibitors  Mechanism study  Molecular dynamics   Theoretical Calculations Facilitating Catalysis for Advanced Lithium-Sulfur Batteries 期刊论文  OAI收割 MOLECULES, 2023, 卷号: 28, 期号: 21, 页码: 27 作者:  Fang, Xue-Ting;  Zhou, Lei;  Chen CG(陈春光);  Danilov, Dmitri L.;  Qiao, Fen   |  收藏  |  浏览/下载：7/0  |  提交时间：2023/12/11 calculations  catalysis  Lithium-sulfur batteries  polysulfides  conversion kinetics   Loops Mediate Agonist-Induced Activation of the Stimulator of Interferon Genes Protein 期刊论文  OAI收割 JOURNAL OF CHEMICAL INFORMATION AND MODELING, 2023, 页码: 9 作者:  Li, Rui;  Chen, Lin;  He, Xinheng;  Cao, Duanhua;  Zhang, Zehong   |  收藏  |  浏览/下载：7/0  |  提交时间：2023/12/11 Discovery of Potent and Selective CB2 Agonists Utilizing a Function-Based Computational Screening Protocol 期刊论文  OAI收割 ACS CHEMICAL NEUROSCIENCE, 2023, 卷号: 14, 期号: 21, 页码: 3941-3958 作者:  Ge, Haixia;  Ji, Beihong;  Fang, Jiahui;  Wang, Jiayang;  Li, Jing   |  收藏  |  浏览/下载：8/0  |  提交时间：2023/12/11 function-based ligand design  receptor-ligandbinding profile  CB1/CB2  structure-activityrelationship   Identification of 3H-benzo[b] [1,4] diazepine derivatives as PPAR alpha agonists by in silico studies and biochemical evaluation 期刊论文  OAI收割 JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2023, 页码: 16 作者:  Li, Yue;  Lv, Mengjia;  Shen, Meiling;  Gu, Xi;  Zhang, Li   |  收藏  |  浏览/下载：11/0  |  提交时间：2023/10/17 NAFLD  PPAR alpha agonist  virtual screening  biochemical evaluation   Structure-Based Ligand Discovery Targeting the Transmembrane Domain of Frizzled Receptor FZD7 期刊论文  OAI收割 JOURNAL OF MEDICINAL CHEMISTRY, 2023, 页码: 14 作者:  Li, Cuixia;  Wu, Yiran;  Wang, Wenli;  Xu, Lu;  Zhou, Yan   |  收藏  |  浏览/下载：14/0  |  提交时间：2023/10/17 Diffusion Kinetics-Based Loading of Lipoic Acid into Cyclodextrin Metal-Organic Frameworks via a Solvent-Free Method and Mechanism of Stability Enhancement 期刊论文  OAI收割 JOURNAL OF PHYSICAL CHEMISTRY C, 2023, 卷号: 127, 期号: 23, 页码: 11317-11327 作者:  Yang, Ting;  Xu, Huiyun;  Zhou, Yong;  Zhang, Ying;  Wang, Caifen   |  收藏  |  浏览/下载：22/0  |  提交时间：2023/10/17 Highly active and stable CuxFey/AC-H catalysts with CuFe2O4 for NO reduction by CO in the presence of H2O and SO2 under regeneration gas 期刊论文  OAI收割 CHEMICAL ENGINEERING JOURNAL, 2023, 卷号: 458, 页码: 15 作者:  Xu, Zhicheng;  Li, Yuran;  Lin, Yuting;  Wang, Bin;  Wang, Qiang   |  收藏  |  浏览/下载：0/0  |  提交时间：2023/05/19 Bimetallic modification  NO reduction  Regeneration gas  H2O promoting effect  Activated carbon   Molecular dynamics study on the behavior and binding mechanism of target protein Transgelin-2 with its agonist TSG12 for anti-asthma drug discovery 期刊论文  OAI收割 COMPUTERS IN BIOLOGY AND MEDICINE, 2023, 卷号: 153, 页码: 7 作者:  Wu, Leyun;  Wang, Guangpu;  Zhou, Liping;  Mo, Mengxia;  Shi, Yulong   |  收藏  |  浏览/下载：15/0  |  提交时间：2023/04/10 Pharmaceutical sciences  Molecular dynamics simulation  Free energy calculation  Asthma  Target protein  Transgelin-2  Agonist   Quantum chemistry insight into the interactions of 1,3-diisopropoxycalix[4]arenecrown-6 with alkali metal cations: Structure, selectivity, and solvation 期刊论文  OAI收割 JOURNAL OF MOLECULAR LIQUIDS, 2023, 卷号: 370, 页码: 9 作者:  Xing, Huifang;  Meng, Qiyu;  Yang, Liangrong;  Chen, Congmei;  Liu, Huizhou   |  收藏  |  浏览/下载：18/0  |  提交时间：2023/02/24 BPC6  Alkali metal cations  DFT  IGMH  Selectivity  Solvation