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Frontiers in Chemistry|May 17, 2018
Conceptual DFT Study of the Local Chemical Reactivity of the Colored BISARG Melanoidin and Its Protonated DerivativeJuan Frau, Daniel Glossman-MitnikChemistry Central Journal|July 20, 2012
DFT study of the effect of substituents on the absorption and emission spectra of IndigoFrancisco Cervantes-Navarro, Daniel Glossman-MitnikMolecules (Basel, Switzerland)|December 6, 2016
A Molecular Electron Density Theory Study of the Chemical Reactivity of Cis- and Trans-ResveratrolJuan Frau, Francisco Muñoz, Daniel Glossman-MitnikMolecules (Basel, Switzerland)|March 25, 2017
Computational Prediction of the Protonation Sites of Ac-Lys-(Ala)n-Lys-NH2 Peptides through Conceptual DFT DescriptorsSebastián Sastre, Juan Frau, Daniel Glossman-MitnikJournal of Molecular Modeling|January 30, 2007
CHIH-DFT determination of the molecular structure infrared spectra, UV spectra and chemical reactivity of three antitubercular compounds: Rifampicin, Isoniazid and PyrazinamideAlejandra Favila, Marco Gallo, Daniel Glossman-MitnikJournal of Molecular Modeling|January 20, 2018
Assessment of ten density functionals through the use of local hyper-softness to get insights about the catalytic activity : Iron-based organometallic compounds for ethylene polymerization as testing moleculesJorge I Martínez-Araya, Daniel Glossman-MitnikACS Omega|December 7, 2020
KID Procedure Applied on the [(PY5Me2)MoO]+ ComplexDaniel Glossman-Mitnik, Jorge I Martínez-ArayaJournal of Molecular Graphics & Modelling|November 3, 2025
Computational strategies for exploring amino acids and peptides as inhibitors of Advanced Glycation EndproductsNorma Flores-Holguín, Juan Frau, Daniel Glossman-MitnikMolecules (Basel, Switzerland)|September 16, 2020
Conceptual DFT-Based Computational Peptidology of Marine Natural Compounds: Discodermins A-HNorma Flores-Holguín, Juan Frau, Daniel Glossman-MitnikMolecules (Basel, Switzerland)|March 24, 2019
Chemical Reactivity Theory and Empirical Bioactivity Scores as Computational Peptidology Alternative Tools for the Study of Two Anticancer Peptides of Marine OriginJuan Frau, Norma Flores-Holguín, Daniel Glossman-MitnikPageof 9