1.QSPR Study on the Melting Points of a Diverse Set of Potential Ionic Liquids by Projection Pursuit Regression

Ren, YY, Qin, J, Liu     More...

Ren, YY, Qin, J, Liu, HX, Yao, XJ, Liu, MC     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2009, Volume 28, Issue 11-12, Pages 1237-1244

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WOS核心合集引用: 24  发表年影響因子:  3.027 

2.In silico prediction of inhibition activity of pyrazine - Pyridine biheteroaryls as VEGFR-2 inhibitors based on least squares support vector machines

Li, JZ, Qin, J, Liu,     More...

Li, JZ, Qin, J, Liu, HX, Yao, XJ, Liu, MC, Hu, ZD     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2008, Volume 27, Issue 2, Pages 157-164

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WOS核心合集引用: 6  发表年影響因子:  2.594 

3.Accurate prediction of aquatic toxicity of aromatic compounds based on Genetic Algorithm and Least Squares Support Vector Machines

Lei, BL, Li, JZ, Liu     More...

Lei, BL, Li, JZ, Liu, HX, Yao, XJ     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2008, Volume 27, Issue 7, Pages 850-865

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WOS核心合集引用: 12  发表年影響因子:  2.594 

4.QSAR models for the dermal penetration of polycyclic aromatic hydrocarbons based on Gene Expression Programming

Wang, T, Si, HZ, Che     More...

Wang, T, Si, HZ, Chen, PP, Zhang, KJ, Yao, XJ     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2008, Volume 27, Issue 7, Pages 913-921

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WOS核心合集引用: 5  发表年影響因子:  2.594 

5.Accurate and Validated Quantitative Structure - Activity Relationship Model of Caspase-mediated Apoptosis-inducing Activity of Phenolic Compounds Using Density Functional Theory Calculation and Genetic Algorithm - Multiple Linear Regression

Chang, J, Lei, BL, L     More...

Chang, J, Lei, BL, Li, JZ, Li, SY, Shen, YL, Yao, XJ     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2008, Volume 27, Issue 11-12, Pages 1318-1325

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WOS核心合集引用: 3  发表年影響因子:  2.594 

6.Study on the structure-activity relationship of new anti-HIV nucleoside derivatives based on the support vector machine method

Wang, J, Liu, HX, Qi     More...

Wang, J, Liu, HX, Qin, S, Yao, XJ, Liu, MC, Hu, ZD, Fan, BT     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2007, Volume 26, Issue 2, Pages 161-172

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WOS核心合集引用: 6  发表年影響因子:  2.117 

7.Quantitative Structure-Activity Relationship study on a series of novel ligands binding to central benzodiazepine receptor by using the combination of Heuristic Method and Support Vector Machines

Qin, S, Liu, HX, Wan     More...

Qin, S, Liu, HX, Wang, J, Yao, XJ, Liu, MC, Hu, ZD, Fan, BT     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2007, Volume 26, Issue 4, Pages 443-451

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WOS核心合集引用: 9  发表年影響因子:  2.117 

8.Support vector machine-based QSPR for the prediction of van der Waals' constants

Luan, F, Zhang, RS,     More...

Luan, F, Zhang, RS, Yao, XJ, Liu, MC, Hu, ZD, Fan, BT     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2005, Volume 24, Issue 2, Pages 227-239

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WOS核心合集引用: 13  发表年影響因子:  1.826 

9.Insight into the bioactivity and metabolism of human glucagon receptor antagonists from 3D-QSAR analyses

Chen, HF, Yao, XJ, P     More...

Chen, HF, Yao, XJ, Petitjean, M, Xia, HO, Yao, JH, Panaye, A, Doucet, JP, Fan, BT     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2004, Volume 23, Issue 8, Pages 603-620

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WOS核心合集引用: 7  发表年影響因子:  1.882 

10.CoMFA/CoMSIA/HQSAR and docking study of the binding mode of selective cyclooxygenase (COX-2) inhibitors

Chen, HF, Li, Q, Yao     More...

Chen, HF, Li, Q, Yao, XJ, Fan, BT, Yuan, SG, Panaye, A, Doucet, JP     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2004, Volume 23, Issue 1, Pages 36-55

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WOS核心合集引用: 25  发表年影響因子:  1.882 

11.3D-QSAR and docking study of the binding mode of steroids to progesterone receptor in active site

Chen, HF, Li, Q, Yao     More...

Chen, HF, Li, Q, Yao, XJ, Fan, BT, Yuan, SG, Panaye, A, Doucet, JP     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2003, Volume 22, Issue 6, Pages 604-613

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WOS核心合集引用: 17 

12.Quantitative structure property relationship models for the prediction of liquid heat capacity

Yao, XJ, Fan, BT, Do     More...

Yao, XJ, Fan, BT, Doucet, JP, Panaye, A, Liu, MC, Zhang, RS, Zhang, XY, Hu, ZD     Less

QSAR & COMBINATORIAL SCIENCE[1611-020X], Published 2003, Volume 22, Issue 1, Pages 29-48

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WOS核心合集引用: 16