中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
上海药物研究所 [6]
新疆理化技术研究所 [1]
大连化学物理研究所 [1]
水生生物研究所 [1]
生态环境研究中心 [1]
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OAI收割 [10]
内容类型
期刊论文 [9]
学位论文 [1]
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2020 [1]
2018 [1]
2017 [1]
2016 [1]
2013 [2]
2010 [2]
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学科主题
Chemistry [2]
Mathematic... [1]
Pharmacolo... [1]
物理化学 [1]
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Simulative structure and binding sites of lyral with olfactory receptor 10J5 using computational prediction methods
期刊论文
OAI收割
JOURNAL OF TOXICOLOGY AND ENVIRONMENTAL HEALTH-PART A-CURRENT ISSUES, 2020, 卷号: 83, 期号: 1, 页码: 1-8
作者:
Wang, P (Wang, Pu)[ 1 ]
;
Zhang, R (Zhang, Rui)[ 2,3 ]
;
Yu, SB (Yu, Shunbang)[ 1 ]
;
Lee, C (Lee, Charles)[ 4 ]
;
Wang, H (Wang, He)[ 1 ]
  |  
收藏
  |  
浏览/下载:28/0
  |  
提交时间:2020/03/16
Homology modeling
ligand docking
binding sites
olfactory receptor
lyral
Recent Trends and Applications of Molecular Modeling in GPCR-Ligand Recognition and Structure-Based Drug Design
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 2018, 卷号: 19, 期号: 7
作者:
Yuan, Xiaojing
;
Xu, Yechun
  |  
收藏
  |  
浏览/下载:29/0
  |  
提交时间:2019/01/08
GPCR
receptor-ligand recognition
drug design
molecular modeling
molecular dynamics
docking
binding affinity
binding pathway
Structure-Based Investigation on the Binding and Activation of Typical Pesticides With Thyroid Receptor
期刊论文
OAI收割
TOXICOLOGICAL SCIENCES, 2017, 卷号: 160, 期号: 2, 页码: 205-216
作者:
Xiang, Dandan
;
Han, Jian
;
Yao, Tingting
;
Wang, Qiangwei
;
Zhou, Bingsheng
  |  
收藏
  |  
浏览/下载:39/0
  |  
提交时间:2019/07/03
pesticides
thyroid receptor
ligand binding assay
surface plasmon resonance
molecular docking
Discovery and structural optimization of 4-(4-(benzyloxy) phenyl)-3,4-dihydropyrimidin-2(1H)-ones as RORc inverse agonists
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2016, 卷号: 37, 期号: 11, 页码: 1516
作者:
Wu Xishan
;
Wang Rui
;
Xing Yanli
;
Xue Xiaoqian
;
Zhang Yan
  |  
收藏
  |  
浏览/下载:95/0
  |  
提交时间:2020/12/24
GAMMA-T
ORPHAN RECEPTORS
CELL-DIFFERENTIATION
LIGAND
IDENTIFICATION
MODULATORS
DERIVATIVES
PROTEIN
INHIBITORS
DOCKING
nuclear receptor
RORc
inverse agonist
SAR
structure-based optimization
autoimmune disease
3-Acyl-5-hydroxybenzofuran derivatives as potential anti-estrogen breast cancer agents: A combined experimental and theoretical investigation
期刊论文
OAI收割
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:38/0
  |  
提交时间:2014/09/11
3-Acyl-5-hydroxybenzofuran
Breast cancer
Estrogen receptor alpha (ER alpha)
Quantum Mechanics Polarized Ligand Docking (QPLD)
羟基化多溴联苯醚与人雌激素受体相互作用的构效关系研究
学位论文
OAI收割
硕士, 北京: 中国科学院研究生院, 2013
李欣欣
收藏
  |  
浏览/下载:46/0
  |  
提交时间:2014/08/21
羟基化多溴联苯醚
雌激素受体
表面等离子体共振
MVLN报告基因检测体 系
分子对接
OH-PBDEs
estrogen receptor
ligand binding assay
surface plasmon resonance
MVLN cell transactivation assay
molecular docking
Three-Dimensional Quantitative Structure-Activity Relationships of flavonoids and estrogen receptors based on docking
期刊论文
OAI收割
CHINESE SCIENCE BULLETIN, 2010, 卷号: 55, 期号: 15, 页码: 1488-1494
作者:
Wu Yang
;
Wang Yong
  |  
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2019/01/08
flavonoids
ligand-receptor docking
Three-Dimensional Quantitative Structure Activity Relationship (3D-QSAR)
comparative molecular field analysis (CoMFA)
molecular similarity index analysis (CoMSIA)
Three-dimensional quantitative structure activity relationship of flavonoids and estrogen receptor based on docking
期刊论文
OAI收割
Chinese Science Bulletin, 2010, 卷号: 55, 期号: 2, 页码: 132-139
作者:
Wu Yang
;
Wang Yong
;
Zhang Aiqian
;
Yu Hongxia
;
Wang Liansheng
  |  
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2019/01/08
(3D-QSAR)
(CoMFA)
(CoMSIA)
flavonoids
ligand-receptor docking
three-dimensional quantitative structure activity relationship(3D-QSAR)
comparative molecular field analysis(CoMFA)
molecular similarity index analysis(CoMSIA)