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兰州大学 [47]
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期刊论文 [47]
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2016 [1]
2015 [1]
2014 [1]
2013 [3]
2012 [3]
2011 [2]
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pharmacol... [47]
chemistry [25]
computer ... [20]
biochemist... [7]
toxicology [1]
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学科主题:pharmacology & pharmacy
专题:兰州大学
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Synthesis, biological activities and structure-activity relationships for new avermectin analogues
期刊论文
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2016, 卷号: 121, 页码: 422-432
作者:
Zhang, J
;
Nan, X
;
Yu, HT
;
Cheng, PL
;
Zhang, Y
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2017/01/11
Avermectin
Structural modifications
Insecticidal activities
QSAR analysis
Study on the active mechanism of beta-secretase inhibitors by molecular simulations
期刊论文
EUROPEAN JOURNAL OF PHARMACEUTICAL SCIENCES, 2015, 卷号: 76, 页码: 138-148
作者:
Tian, YL
;
Lv, M
;
Li, JJ
;
Xu, T
;
Zhai, HL
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2017/01/11
Proteolytic enzyme beta-secretase
Binding mechanism
3D-QSAR
Molecular docking
Molecular dynamics
Studies on the inhibitory models of pyrazoline derivatives as EGFR kinase inhibitors by 3D-QSAR and molecular docking
期刊论文
MEDICINAL CHEMISTRY RESEARCH, 2014, 卷号: 23, 期号: 6
-
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2014/12/05
Pyrazole derivatives
EGFR inhibitors
3D-QSAR
CoMFA
CoMSIA
Molecular docking
Semisynthesis and quantitative structure-activity relationship (QSAR) study of some cholesterol-based hydrazone derivatives as insecticidal agents
期刊论文
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 2013, 卷号: 23, 期号: 17
-
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  |  
浏览/下载:4/0
  |  
提交时间:2014/12/05
Cholesterol
Insecticidal activity
Botanical insecticide
Structural modification
QSAR
Mythimna separata (Walker)
Synthesis and insect antifeedant activity of stilbene derivatives against Brontispa longissima Larvae
期刊论文
MEDICINAL CHEMISTRY RESEARCH, 2013, 卷号: 22, 期号: 5, 页码: 2196-2206
作者:
Liu, YQ
;
Li, XJ
;
Zhao, CY
;
Lu, Y
;
Li, WQ
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  |  
浏览/下载:2/0
  |  
提交时间:2015/12/29
Stilbenes
insect antifeedants
Brontispa longissima
CoMFA
3D-QSAR study
QSAR Modeling for the Antimalarial Activity of 1,4-Naphthoquinonyl Derivatives as Potential Antimalarial Agents
期刊论文
CURRENT COMPUTER-AIDED DRUG DESIGN, 2013, 卷号: 9, 期号: 1
-
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  |  
浏览/下载:3/0
  |  
提交时间:2014/12/05
Antimalarial activity
dug design
malaria
molecular design
multiple linear regression (MLR)
1,4-Naphthoquinonyl derivatives
QSAR
radial basis function neural network (RBFNN)
QSAR Studies of PTP1B Inhibitors: 1, 2-Naphthoquinone Derivatives
期刊论文
LETTERS IN DRUG DESIGN & DISCOVERY, 2012, 卷号: 9, 期号: 10
-
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2014/12/05
Diabetes mellitus
Multiple linear regression (MLR)
1, 2-naphoquinone derivatives
Protein tyrosine phosphatase 1B (PTP1B)
Quantitative structure-activity relationships (QSAR)
Radial basis function neural networks (RBFNN)
QSAR Studies of PTP1B Inhibitors: Recent Advances and Perspectives
期刊论文
CURRENT MEDICINAL CHEMISTRY, 2012, 卷号: 19, 期号: 25
-
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2014/12/05
Diabetes mellitus
protein tyrosine phosphatase 1B inhibitors
type 2 diabetes
drug design
virtual screening
quantitative structure-activity relationships (QSAR)
3D-QSAR
comparative molecular field analysis (CoMFA)
comparative molecular similarity indices analysis (CoMSIA)
2D-QSAR
multiple linear regression (MLR)
radial basis function neural networks (RBFNN)
Simple and accurate approaches to predict the activity of benzothiadiazine derivatives as HCV inhibitors
期刊论文
MEDICINAL CHEMISTRY RESEARCH, 2012, 卷号: 21, 期号: 8
-
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2014/12/05
BMLR
HCV
QSAR
RBFNN
SVM
Prediction of the binding affinities of adenosine A(2A) receptor antagonists based on the heuristic method and support vector machine
期刊论文
MEDICINAL CHEMISTRY RESEARCH, 2011, 卷号: 20, 期号: 8, 页码: 1220-1228
作者:
Lu, P
;
Wei, X
;
Zhang, RS
;
Yuan, YN
;
Gong, ZG
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2015/12/15
QSAR
Adenosine A(2A) receptor antagonists
Molecular descriptor
Heuristic method
Support vector machine
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