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兰州大学 [19]
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期刊论文 [18]
会议论文 [1]
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2015 [1]
2014 [3]
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chemistry [9]
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专题:兰州大学
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A Combined Quantitative Structure-Activity Relationship Research of Quinolinone Derivatives as Androgen Receptor Antagonists
期刊论文
COMBINATORIAL CHEMISTRY & HIGH THROUGHPUT SCREENING, 2015, 卷号: 18, 期号: 9, 页码: 834-845
作者:
Wang, YW
;
Bai, F
;
Cao, H
;
Li, JZ
;
Liu, HX
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2017/01/11
Androgen receptor (AR)
comparative molecular field analysis (CoMFA)
prostate cancer (PCa)
comparative molecular similarity indices analysis (CoMSIA)
multiple linear regression (MLR)
Combined molecular docking, molecular dynamics simulation and quantitative structure-activity relationship study of pyrimido[1,2-c] [1,3]benzothiazin-6-imine derivatives as potent anti-HIV drugs
期刊论文
JOURNAL OF MOLECULAR STRUCTURE, 2014, 卷号: 1067, 页码: 1-13
作者:
Deng, FF
;
Xie, MH
;
Zhang, XY
;
Li, PZ
;
Tian, YL
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2015/05/21
MLR
SMILES
Molecular docking
Molecular dynamics
HIV inhibitors
Study on the antagonists for the orphan G protein-coupled receptor GPR55 by quantitative structure-activity relationship
期刊论文
CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS, 2014, 卷号: 131
-
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2014/12/05
MLR
SMILES
CoMFA
CoMSIA
GPR55 antagonists
Multivariate linear wind speed forecast method based on the SSA and WRF model
会议论文
2013 2nd International Conference on Sustainable Energy and Environmental Engineering, ICSEEE 2013, Shenzhen, China, December 28, 2013 - December 29, 2013
作者:
Zhao, Yan Ru
;
Zhang, Hong Li
;
Su, Zhong Yue
;
Zhang, Wen Yu
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2017/01/18
Weather forecasting
Electric power generation
Energy conservation
Forecasting
Linear regression
Mean square error
Spectrum analysis
Wind
Wind power
Electric power development
MLR
Multiple linear regressions
Root mean square errors
Singular spectrum analysis
SSA
Wind speed
WRF
Structural requirements of 3-carboxyl-4(1H)-quinolones as potential antimalarials from 2D and 3D QSAR analysis
期刊论文
JOURNAL OF MOLECULAR GRAPHICS & MODELLING, 2013, 卷号: 44, 页码: 266-277
作者:
Li, JZ
;
Li, SY
;
Bai, CL
;
Liu, HX
;
Gramatica, P
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2015/12/29
4(1H)-quinolones
Antimalarial
MLR
CoMFA
CoMSIA
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
-
收藏
  |  
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)
Prediction of the maximum absorption wavelength of azobenzene dyes by QSPR tools
期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2011, 卷号: 83, 期号: 1
-
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2014/12/05
Azobenzene dyes
Maximum absorption wavelength
QSPR
MLR
RBFNN
Molecular modeling
QSAR Studies on Aminothiazole Derivatives as Aurora A Kinase Inhibitors
期刊论文
CHEMICAL BIOLOGY & DRUG DESIGN, 2010, 卷号: 76, 期号: 6
-
收藏
  |  
浏览/下载:4/0
  |  
提交时间:2014/12/05
aminothiazole
Aurora kinases
CoMFA
CoMSIA
GA-MLR
QSAR
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