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Exploring the QSAR’s pbkp_redictive truthfulness of the novel N-tuple discrete derivative indices on benchmark datasets
ArticleAbstract: Graph derivative indices (GDIs) have recently been defined over N-atoms (N = 2, 3 and 4) simultaneouPalabras claves:CARDD suite, DIVATI module, feature selection, free and open source software, genetic algorithm, Friedman test for multiple comparisons, graph derivative indices, Keysfinder framework, Molecular descriptors, multiple linear regression, QSAR model, TOMOCOMD systemAutores:Hurtado E., Orozco-Ugarriza M.E., Oscar Martínez Santiago, Ramos Y., Rivera-Borroto O.M., Treto-Suarez M.A., Vergara-Murillo F., Vivas-Reyes R., Yoan Martínez López, Yovani Marrero-PonceFuentes:scopusQSAR study for the fish toxicity of benzene derivatives
ArticleAbstract: We searched Quantitative Structure-Toxicity models for pbkp_redicting the fish toxicity against PoecPalabras claves:Benzene derivatives, Pc, Poecilia reticulata, QSAR Theory, Replacement methodAutores:Castro E.A., Marrugo H J., Ortiz E.V., Pablo R. Duchowicz, Vivas-Reyes R.Fuentes:scopus