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兰州大学机构库

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Global, local and novel consensus quantitative structure-activity relationship studies of 4-(Phenylaminomethylene) isoquinoline-1, 3 (2H, 4H)-diones as potent inhibitors of the cyclin-dependent kinase 4 期刊论文
ANALYTICA CHIMICA ACTA, 2009, 卷号: 644, 期号: 1-2
Authors:  Lei, BL;  Xi, LL;  Li, JZ;  Liu, HX;  Yao, XJ(姚小军);  Yao, XJ (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Peoples R China.
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Cyclin-dependent kinase 4 (CDK4)  Quantitative structure-activity relationship (QSAR)  Local lazy regression (LLR)  Consensus models  
Validated quantitative structure-activity relationship analysis of a series of 2-aminothiazole based p56(Lck) inhibitors 期刊论文
ANALYTICA CHIMICA ACTA, 2009, 卷号: 631, 期号: 1
Authors:  Li, JZ;  Du, J;  Xi, LL;  Liu, HX;  Yao, XJ(姚小军);  Liu, MC;  Yao, XJ (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Peoples R China.
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Lymphocyte-specific kinase (LCK)  Genetic algorithm (GA)  Multiple linear regression (MLR)  Quantitative structure-activity relationship (QSAR)  
Quantitative structure-property relationship study for estimation of quantitative calibration factors of some organic compounds in gas chromatography 期刊论文
ANALYTICA CHIMICA ACTA, 2008, 卷号: 612, 期号: 2
Authors:  Luan, F;  Liu, HT;  Wen, YY;  Zhang, XY(张晓昀);  Luan, F (reprint author), Yantai Univ, Dept Appl Chem, Yantai 264005, Peoples R China.
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quantitative calibration factors  multiple linear regression  radial basis function neural network  quantitative structure-property relationship  
Using classification structure pharmacokinetic relationship (SCPR) method to predict drug bioavailability based on grid-search support vector machine 期刊论文
ANALYTICA CHIMICA ACTA, 2007, 卷号: 601, 期号: 2
Authors:  Wang, J;  Du, HY;  Yao, XJ(姚小军);  Hu, ZD(胡之德);  Hu, ZD (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Peoples R China.
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classification structure  pharmacokinetic relationship  bioavailability  linear discriminant analysis  grid-search support vector machine  
Quantitative structure-retention relationships for organic pollutants in biopartitioning micellar chromatography 期刊论文
ANALYTICA CHIMICA ACTA, 2007, 卷号: 598, 期号: 1
Authors:  Xia, B;  Ma, W;  Zhang, XY(张晓昀);  Fan, B;  Zhang, X (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Peoples R China.
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quantitative structure-retention relationship  heuristic method  radial basis function neural networks  biopartitioning micellar chromatography  
Quantitative structure activity relationship model for predicting the depletion percentage of skin allergic chemical substances of glutathione 期刊论文
ANALYTICA CHIMICA ACTA, 2007, 卷号: 591, 期号: 2
Authors:  Si, HZ;  Wang, T;  Zhang, KJ;  Duan, YB;  Yuan, SP;  Fu, AP;  Hu, ZD(胡之德);  Si, HZ (reprint author), Qingdao Univ, Inst Computat Sci & Engn, Qingdao 266071, Peoples R China.
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allergic contact dermatitis  gene expression programming  quantitative structure activity relationship  heuristic method  depletion percent of glutathione  
Prediction of ozone tropospheric degradation rate constants by projection pursuit regression 期刊论文
ANALYTICA CHIMICA ACTA, 2007, 卷号: 589, 期号: 1
Authors:  Ren, YY;  Liu, HX;  Yao, XJ(姚小军);  Liu, MC;  Yao, XJ (reprint author), Lanzhou Univ, Dept Chem, 222 Tianshui S Rd, Lanzhou 730000, Peoples R China.
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quantitative structure-property relationship  ozone tropospheric degradation rate constants  heuristic method  support vector machine  projection pursuit regression  
Prediction of T-cell epitopes based on least squares support vector machines and amino acid properties 期刊论文
ANALYTICA CHIMICA ACTA, 2007, 卷号: 584, 期号: 1
Authors:  Li, SY(李书艳);  Yao, XJ(姚小军);  Liu, HX;  Li, JZ;  Fan, BT;  Yao, XJ (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Peoples R China.
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T-cell epitopes  classification  least squares support vector machines  ROC curve  
Structure-activity relationship study of oxindole-based inhibitors of cyclin-dependent kinases based on least-squares support vector machines 期刊论文
ANALYTICA CHIMICA ACTA, 2007, 卷号: 581, 期号: 2
Authors:  Li, JZ;  Liu, HX;  Yao, XJ(姚小军);  Liu, MC;  Hu, ZD(胡之德);  Fan, BT;  Yao, XJ (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Peoples R China.
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structure-activity relationship (SAR)  cyclin-dependent kinases (CDKs)  inhibitor  linear discriminant analysis (LDA)  least-squares support vector machines (LS-SVMs)  oxindole  
Classification study of skin sensitizers based on support vector machine and linear discriminant analysis 期刊论文
ANALYTICA CHIMICA ACTA, 2006, 卷号: 572, 期号: 2
Authors:  Ren, YY;  Liu, HX;  Xue, CX;  Yao, XJ(姚小军);  Liu, MC;  Fan, BT;  Yao, XJ (reprint author), Lanzhou Univ, Dept Chem, Lanzhou 730000, Peoples R China.
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classification  skin sensitization  linear discriminant analysis  support vector machine