1.The prediction of human oral absorption for diffusion rate-limited drugs based on heuristic method and support vector machine

Liu, HX, Hu, RJ, Zha     More...

Liu, HX, Hu, RJ, Zhang, RS, Yao, XJ, Liu, MC, Hu, ZD, Fan, BT     Less

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN[0920-654X], Published 2005, Volume 19, Issue 1, Pages 33-46

收錄情况： WOS SCOPUS

WOS核心合集引用: 38  2024影響因子:  3.1  发表年影響因子:  2.082 

2.Prediction of the tissue/blood partition coefficients of organic compounds based on the molecular structure using least-squares support vector machines

Liu, HX, Yao, XJ, Zh     More...

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

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN[0920-654X], Published 2005, Volume 19, Issue 7, Pages 499-508

收錄情况： WOS SCOPUS

WOS核心合集引用: 33  2024影響因子:  3.1  发表年影響因子:  2.082 

3.Comparative molecular field analysis (CoMFA) and comparative molecular similarity indices analysis (CoMSIA) of thiazolone derivatives as hepatitis C virus NS5B polymerase allosteric inhibitors

Lei, BL, Du, J, Li,     More...

Lei, BL, Du, J, Li, SY, Liu, HX, Ren, YY, Yao, XJ     Less

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN[0920-654X], Published 2008, Volume 22, Issue 10, Pages 711-725

收錄情况： WOS SCOPUS

WOS核心合集引用: 16  2024影響因子:  3.1  发表年影響因子:  3.620 

4.Discovery of small molecules binding to the normal conformation of prion by combining virtual screening and multiple biological activity evaluation methods

Li, LL, Wei, W, Jia,     More...

Li, LL, Wei, W, Jia, WJ, Zhu, YC, Zhang, Y, Chen, JH, Tian, JQ, Liu, HX, He, YX, Yao, XJ     Less

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN[0920-654X], Published 2017, Volume 31, Issue 12, Pages 1053-1062

收錄情况： WOS SCOPUS

WOS核心合集引用: 5  2024影響因子:  3.1  发表年影響因子:  2.356 

5.QSAR and classification models of a novel series of COX-2 selective inhibitors: 1,5-diarylimidazoles based on support vector machines

Liu, HX, Zhang, RS,     More...

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

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN[0920-654X], Published 2004, Volume 18, Issue 6, Pages 389-399

收錄情况： WOS SCOPUS

WOS核心合集引用: 36  2024影響因子:  3.1  发表年影響因子:  2.729 

6.Molecular basis of P450 OleT(JE): an investigation of substrate binding mechanism and major pathways

Du, J, Liu, L, Guo,     More...

Du, J, Liu, L, Guo, LZ, Yao, XJ, Yang, JM     Less

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN[0920-654X], Published 2017, Volume 31, Issue 5, Pages 483-495

收錄情况： WOS SCOPUS

WOS核心合集引用: 15  2024影響因子:  3.1  发表年影響因子:  2.356 

7.Discovery of novel IDO1 inhibitors via structure-based virtual screening and biological assays

Ge, HZ, Mao, LF, Zha     More...

Ge, HZ, Mao, LF, Zhao, J, Wang, YW, Shi, DF, Yang, X, Wang, XR, Liu, HX, Yao, XJ     Less

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN[0920-654X], Published 2021, Volume 35, Issue 5, Pages 679-694

收錄情况： WOS SCOPUS

WOS核心合集引用: 4  2024影響因子:  3.1  发表年影響因子:  4.179