机构

• 上海药物研究所 [8]

采集方式

• OAI收割 [8]

内容类型

• 期刊论文 [8]

发表日期

• 2022 [2]
• 2018 [1]
• 2016 [1]
• 2015 [1]
• 2014 [1]
• 2008 [1]
• 更多

学科主题

• Biochemist... [1]
• Chemistry [1]
• Pharmacolo... [1]

筛选

浏览/检索结果: 共8条，第1-8条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择题名升序题名降序提交时间升序提交时间降序作者升序作者降序发表日期升序发表日期降序 Deffini: A family-specific deep neural network model for structure-based virtual screening 期刊论文  OAI收割 COMPUTERS IN BIOLOGY AND MEDICINE, 2022, 卷号: 151, 页码: 8 作者:  Zhou, Dixin;  Liu, Fei;  Zheng, Yiwen;  Hu, Liangjian;  Huang, Tao   |  收藏  |  浏览/下载：19/0  |  提交时间：2023/04/10 Virtual screening  Protein family -specific model  Structure -based  Convolutional neural network  Drug discovery   Recent progress in fragment-based drug discovery facilitated by NMR spectroscopy 期刊论文  OAI收割 Magnetic Resonance Letters, 2022, 卷号: 2, 期号: 2, 页码: 107-118 作者:  Wang, Lei;  Gao, Jia;  Ma, Rongsheng;  Liu, Yaqian;  Liu, Mingqing   |  收藏  |  浏览/下载：22/0  |  提交时间：2024/03/14 Fragment-based lead/drug discovery  NMR spectroscopy  Protein-ligand interaction  Complex structure  Hit-to-lead evolution   Structural studies and drug discovery of G protein-coupled receptors 期刊论文  OAI收割 Chinese Science Bulletin, 2018, 卷号: 63, 期号: 14, 页码: 1362-1373 作者:  Yang Zhenlin;  Wu Beili   |  收藏  |  浏览/下载：28/0  |  提交时间：2019/01/08 G protein-coupled receptor  drug target  3D structure  ligand  structure-based drug discovery   The impact of crystallization conditions on structure-based drug design: A case study on the methylene blue/acetylcholinesterase complex 期刊论文  OAI收割 PROTEIN SCIENCE, 2016, 卷号: 25, 期号: 6, 页码: 1096-1114 作者:  Dym, Orly;  Song, Wanling;  Felder, Clifford;  Roth, Esther;  Shnyrov, Valery   |  收藏  |  浏览/下载：22/0  |  提交时间：2019/01/08 polyethylene glycol  structure-based drug discovery  acetylcholinesterase  methylene blue  decamethonium   policresulenanovelns2bns3proteaseinhibitoreffectivelyinhibitsthereplicationofdenv2virusinbhk21cells 期刊论文  OAI收割 actapharmacologicasinica, 2015, 卷号: 36, 期号: 9, 页码: 1126 作者:  Wu Dengwei;  Mao Fei;  Ye Yan;  Li Jian;  Xu Chuanlian   |  收藏  |  浏览/下载：54/0  |  提交时间：2020/07/01 SMALL-MOLECULE INHIBITORS  STRUCTURE-BASED DISCOVERY  DRUG-LIKE MOLECULES  DENGUE VIRUS  SERINE-PROTEASE  NS3 PROTEASE  PEPTIDE INHIBITORS  NS2B-NS3 PROTEASE  ACCURATE DOCKING  IN-VITRO  Dengue virus  antiviral drug  NS2B/NS3 protease  policresulen  molecular docking  molecular modeling   Targeting the Small- and Intermediate-Conductance Ca2+-Activated Potassium Channels: The Drug-Binding Pocket at the Channel/Calmodulin Interface 期刊论文  OAI收割 NEUROSIGNALS, 2014, 卷号: 22, 期号: 2, 页码: 65-78 作者:  Cui, Meng;  Qin, Guangrong;  Yu, Kunqian;  Bowers, M. Scott;  Zhang, Miao   |  收藏  |  浏览/下载：22/0  |  提交时间：2019/01/08 Small- and intermediate-conductance Ca2+-activated potassium channels  Small-molecule positive modulators  Structure-based drug discovery  Ataxia  Alcohol use disorders  Parkinson's disease   designsynthesisandantitumorevaluationofanewseriesofnsubstitutedthioureaderivatives 期刊论文  OAI收割 actapharmacologicasinica, 2006, 卷号: 27, 期号: 9, 页码: 1259 作者:  Bing Xiong;  Xishan Xiong;  Hong Liu;  Xiaomin Luo;  Hualiang Jiang   |  收藏  |  浏览/下载：15/0  |  提交时间：2020/07/01 EPIDERMAL-GROWTH-FACTOR  TYROSINE KINASE INHIBITORS  STRUCTURE-BASED DISCOVERY  FACTOR RECEPTOR EGFR  IRREVERSIBLE INHIBITORS  CHEMICAL INHIBITORS  BINDING-SITE  PROTEIN  DOMAIN  DOCKING  N-substituted-thiourea derivatives  anti-tumor  SPAC1  tyrosine kinase inhibitor  virtual screening