Wang J - Search Results

1

End-Point Binding Free Energy Calculation with MM/PBSA and MM/GBSA: Strategies and Applications in Drug Design.

Wang E, Sun H, Wang J, Wang Z, Liu H, Zhang JZH, Hou T. Wang E, et al. Among authors: wang j, wang z. Chem Rev. 2019 Aug 28;119(16):9478-9508. doi: 10.1021/acs.chemrev.9b00055. Epub 2019 Jun 24. Chem Rev. 2019. PMID: 31244000

2

Recent advances in computational prediction of drug absorption and permeability in drug discovery.

Hou T, Wang J, Zhang W, Wang W, Xu X. Hou T, et al. Among authors: wang w, wang j. Curr Med Chem. 2006;13(22):2653-67. doi: 10.2174/092986706778201558. Curr Med Chem. 2006. PMID: 17017917 Review.

3

ADME evaluation in drug discovery. 7. Prediction of oral absorption by correlation and classification.

Hou T, Wang J, Zhang W, Xu X. Hou T, et al. Among authors: wang j. J Chem Inf Model. 2007 Jan-Feb;47(1):208-18. doi: 10.1021/ci600343x. J Chem Inf Model. 2007. PMID: 17238266

4

ADME evaluation in drug discovery. 6. Can oral bioavailability in humans be effectively predicted by simple molecular property-based rules?

Hou T, Wang J, Zhang W, Xu X. Hou T, et al. Among authors: wang j. J Chem Inf Model. 2007 Mar-Apr;47(2):460-3. doi: 10.1021/ci6003515. J Chem Inf Model. 2007. PMID: 17381169

5

Fast approaches for molecular polarizability calculations.

Wang J, Xie XQ, Hou T, Xu X. Wang J, et al. J Phys Chem A. 2007 May 24;111(20):4443-8. doi: 10.1021/jp068423w. Epub 2007 Apr 27. J Phys Chem A. 2007. PMID: 17461556 Free article.

6

Development of reliable aqueous solubility models and their application in druglike analysis.

Wang J, Krudy G, Hou T, Zhang W, Holland G, Xu X. Wang J, et al. J Chem Inf Model. 2007 Jul-Aug;47(4):1395-404. doi: 10.1021/ci700096r. Epub 2007 Jun 15. J Chem Inf Model. 2007. PMID: 17569522

7

ADME evaluation in drug discovery. 8. The prediction of human intestinal absorption by a support vector machine.

Hou T, Wang J, Li Y. Hou T, et al. Among authors: wang j. J Chem Inf Model. 2007 Nov-Dec;47(6):2408-15. doi: 10.1021/ci7002076. Epub 2007 Oct 12. J Chem Inf Model. 2007. PMID: 17929911

8

Structure-ADME relationship: still a long way to go?

Hou T, Wang J. Hou T, et al. Among authors: wang j. Expert Opin Drug Metab Toxicol. 2008 Jun;4(6):759-70. doi: 10.1517/17425255.4.6.759. Expert Opin Drug Metab Toxicol. 2008. PMID: 18611116 Review.

9

Aqueous solubility prediction based on weighted atom type counts and solvent accessible surface areas.

Wang J, Hou T, Xu X. Wang J, et al. J Chem Inf Model. 2009 Mar;49(3):571-81. doi: 10.1021/ci800406y. J Chem Inf Model. 2009. PMID: 19226181

10

Recent developments of in silico predictions of intestinal absorption and oral bioavailability.

Hou T, Li Y, Zhang W, Wang J. Hou T, et al. Among authors: wang j. Comb Chem High Throughput Screen. 2009 Jun;12(5):497-506. doi: 10.2174/138620709788489082. Comb Chem High Throughput Screen. 2009. PMID: 19519329 Review.

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