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Nucleic acid quadratic indices of the "macromolecular graph's nucleotides adjacency matrix". Modeling of footprints after the interaction of paromomycin with the HIV-1 Ψ-RNA packaging region
ArticleAbstract: This report describes a new set of macromolecular descriptors of relevance to nucleic acid QSAR/QSPRPalabras claves:Footprinting, Nucleic Acid Quadratic Index, paromomycin, QSPR/QSAR, RNA HIV-1, TOMOCOMD-CANAR approachAutores:Castro E.A., De Armas R.R., González‐díaz H., Nodarse D., Torrens F., Yovani Marrero-Ponce, Zaldivar V.R.Fuentes:googlescopusTotal and local quadratic indices of the "molecular pseudograph's atom adjacency matrix". Application to pbkp_rediction of Caco-2 permeability of drugs
ArticleAbstract: The high interest in the pbkp_rediction of the intestinal absorption for New Chemical Entities (NCEsPalabras claves:Caco-2 cell, Drug Absorption, QSPerR, Quadratic Indices, TOMO-COMD SoftwareAutores:Montero-Cabrera L.A., Ofori E., Pérez M.A.C., Yovani Marrero-Ponce, Zaldivar V.R.Fuentes:googlescopus