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Identification of Active Molecular Sites Using Quantum-Self-Similarity Measures
ArticleAbstract: A novel approach to construct theoretical QSAR models is proposed. This technique, based on the systPalabras claves:Autores:Amat L., Besalu E., Ponec R., Ramón Carbö-D̈orcaFuentes:scopusMolecular Basis of LFER. Modeling of the Electronic Substituent Effect Using Fragment Quantum Self-Similarity Measures
ArticleAbstract: A new approach allowing the theoretical modeling of the electronic substituent effect is proposed. TPalabras claves:Autores:Gironés X., Ponec R., Ramón Carbö-D̈orcaFuentes:scopusMolecular basis of linear free energy relationships. The nature of inductive effect in aliphatic series
ArticleAbstract: The nature of inductive substituent effect on the acidity of aliphatic carboxylic acids was analyzedPalabras claves:Autores:Gironés X., Ponec R., Ramón Carbö-D̈orcaFuentes:scopus