@article{uoadl:2981909, volume = "10", number = "3", pages = "405-414", journal = "Molecular Diversity", issn = "1381-1991", keywords = "1 [(2 hydroxyethoxy)methyl] 6 (phenylthio)thymine; 1 [(2 hydroxyethoxy)methyl] 6 (phenylthio)thymine derivative; unclassified drug, accuracy; antiviral activity; article; drug structure; Human immunodeficiency virus; mathematical model; multiple linear regression analysis; prediction; priority journal; quantitative structure activity relation; step wise multiple regression, Anti-HIV Agents; HIV-1; HIV-1 Reverse Transcriptase; Humans; Linear Models; Neural Networks (Computer); Quantitative Structure-Activity Relationship; Reverse Transcriptase Inhibitors; Thymine", BIBTEX_ENTRY = "article", year = "2006", author = "Afantitis, A. and Melagraki, G. and Sarimveis, H. and Koutentis, P.A. and Markopoulos, J. and Igglessi-Markopoulou, O.", abstract = "A quantitative-structure activity relationship was obtained by applying Multiple Linear Regression Analysis to a series of 80 1-[2-hydroxyethoxy-methyl] -6-(phenylthio) thymine (HEPT) derivatives with significant anti-HIV activity. For the selection of the best among 37 different descriptors, the Elimination Selection Stepwise Regression Method (ES-SWR) was utilized. The resulting QSAR model (RCV2 = 0.8160; SPRESS = 0.5680) proved to be very accurate both in training and predictive stages. © Springer 2006.", title = "A novel simple QSAR model for the prediction of anti-HIV activity using multiple linear regression analysis", doi = "10.1007/S11030-005-9012-2" }