Computational Study of the Chemical Reactivity Properties of the Rhodamine B MoleculeGlossman-Mitnik, Daniel · Procedia Computer Science · 2013

Computational study of substituent effects on the physicochemical properties and chemical reactivity of selected antiparasitic 5-nitrofuransBarrientos-Salcedo, Carolina; Espinoza, Bertha; Soriano-Correa, Catalina · Journal of Molecular Structure · 2018

Computational study of substituent effects on the acidity, toxicity and chemical reactivity of bacteriostatic sulfonamidesSoriano-Correa, Catalina; Barrientos-Salcedo, Carolina; Francisco-Márquez, Misaela; Sainz-Díaz, C. Ignacio · Journal of Molecular Graphics and Modelling · 2018

Biosensors Nanotechnology (Tiwari/Biosensors) || Computational Nanochemistry Study of the Molecular Structure, Spectra and Chemical Reactivity Properties of the BFPF Green Fluorescent Protein ChromophoreTiwari, Ashutosh; Turner, Anthony P.F. · 2014

Chemical Reactivity Theory and Empirical Bioactivity Scores as Computational Peptidology Alternative Tools for the Study of Two Anticancer Peptides of Marine OriginFrau, Juan; Flores-Holguín, Norma; Glossman-Mitnik, Daniel · Molecules · 2019

VARIATIONAL ELECTROSTATICS FOR CHARGE SOLVATIONWANG, ZHEN-GANG · Journal of Theoretical and Computational Chemistry · 2008

Clusters: From dimers to nanoparticlesSpringborg, Michael; Thakkar, Ajit J. · Computational and Theoretical Chemistry · 2013

Theoretical studies on aminoborane oligomersBheema Lingam, Ch.; Tewari, Surya P. · Computational and Theoretical Chemistry · 2013

On tautomerism of diazinonesGraff, Marek; Dobrowolski, Jan Cz. · Computational and Theoretical Chemistry · 2013

Editorial BoardComputational and Theoretical Chemistry · 2014

Editorial BoardComputational and Theoretical Chemistry · 2014

Editorial BoardComputational and Theoretical Chemistry · 2013

Editorial noteThakkar, Ajit J.; Yáñez, Manuel · Computational and Theoretical Chemistry · 2014