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531 related items for PubMed ID: 18280036
21. QSPR studies of impact sensitivity of nitro energetic compounds using three-dimensional descriptors. Xu J, Zhu L, Fang D, Wang L, Xiao S, Liu L, Xu W. J Mol Graph Model; 2012 Jun; 36():10-9. PubMed ID: 22503858 [Abstract] [Full Text] [Related]
22. Linear indices of the "molecular pseudograph's atom adjacency matrix": definition, significance-interpretation, and application to QSAR analysis of flavone derivatives as HIV-1 integrase inhibitors. Marrero-Ponce Y. J Chem Inf Comput Sci; 2004 Jun; 44(6):2010-26. PubMed ID: 15554670 [Abstract] [Full Text] [Related]
23. The study of the relationship between the new topological index A(m) and the gas chromatographic retention indices of hydrocarbons by artificial neural networks. Li H, Zhang YX, Xu L. Talanta; 2005 Oct 15; 67(4):741-8. PubMed ID: 18970234 [Abstract] [Full Text] [Related]
24. Modelling of cytotoxicity data (CC50) of anti-HIV 1-[5-chlorophenyl) sulfonyl]-1H-pyrrole derivatives using calculated molecular descriptors and Levenberg-Marquardt artificial neural network. Arab Chamjangali M. Chem Biol Drug Des; 2009 Apr 15; 73(4):456-65. PubMed ID: 19291106 [Abstract] [Full Text] [Related]
25. Using general regression and probabilistic neural networks to predict human intestinal absorption with topological descriptors derived from two-dimensional chemical structures. Niwa T. J Chem Inf Comput Sci; 2003 Apr 15; 43(1):113-9. PubMed ID: 12546543 [Abstract] [Full Text] [Related]
26. A novel QSPR model for prediction of lower flammability limits of organic compounds based on support vector machine. Pan Y, Jiang J, Wang R, Cao H, Cui Y. J Hazard Mater; 2009 Sep 15; 168(2-3):962-9. PubMed ID: 19329246 [Abstract] [Full Text] [Related]
27. Quantitative structure migration relationship modeling of migration factor for some benzene derivatives in micellar electrokinetic chromatography. Fatemi MH, Shamseddin H, Malekzadeh H. J Sep Sci; 2009 Jun 15; 32(11):1934-40. PubMed ID: 19425021 [Abstract] [Full Text] [Related]
28. Prediction of biological targets using probabilistic neural networks and atom-type descriptors. Niwa T. J Med Chem; 2004 May 06; 47(10):2645-50. PubMed ID: 15115405 [Abstract] [Full Text] [Related]
35. A fuzzy ARTMAP-based quantitative structure-property relationship (QSPR) for the Henry's law constant of organic compounds. Yaffe D, Cohen Y, Espinosa G, Arenas A, Giralt F. J Chem Inf Comput Sci; 2003 May 06; 43(1):85-112. PubMed ID: 12546542 [Abstract] [Full Text] [Related]
36. Anticancer activity of selected phenolic compounds: QSAR studies using ridge regression and neural networks. Nandi S, Vracko M, Bagchi MC. Chem Biol Drug Des; 2007 Nov 06; 70(5):424-36. PubMed ID: 17949360 [Abstract] [Full Text] [Related]
38. Quantitative structure-retention relationship for the Kovats retention indices of a large set of terpenes: a combined data splitting-feature selection strategy. Hemmateenejad B, Javadnia K, Elyasi M. Anal Chim Acta; 2007 May 29; 592(1):72-81. PubMed ID: 17499073 [Abstract] [Full Text] [Related]
40. General melting point prediction based on a diverse compound data set and artificial neural networks. Karthikeyan M, Glen RC, Bender A. J Chem Inf Model; 2005 May 29; 45(3):581-90. PubMed ID: 15921448 [Abstract] [Full Text] [Related] Page: [Previous] [Next] [New Search]