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Electron delocalization and aromaticity in linear polyacenes: Atoms in molecules multicenter delocalization index
ArticleAbstract: Molecular aromaticity in the linear polyacenes is investigated using an atoms in molecules based sixPalabras claves:Autores:Bultinck P., Ponec R., Popelier P.L.A., Rafat M., Ramón Carbö-D̈orca, Van Gheluwe B.Fuentes:scopusMolecular basis of quantitative structure-properties relationships (QSPR): A quantum similarity approach
ArticleAbstract: Since the dawn of quantitative structure-properties relationships (QSPR), empirical parameters relatPalabras claves:Log P, Molecular quantum similarity measures, Quantitative structure- properties relationships (QSPR), Substituent effectAutores:Amat L., Ponec R., Ramón Carbö-D̈orcaFuentes:scopus