William Tiznado
William Tiznado
Departamento de Ciencias Químicas, Universidad Andres Bello, Chile
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Sigma–pi separation of the electron localization function and aromaticity
JC Santos, W Tiznado, R Contreras, P Fuentealba
The Journal of chemical physics 120 (4), 1670-1673, 2004
Definition of a nucleophilicity scale
P Jaramillo, P Pérez, R Contreras, W Tiznado, P Fuentealba
The Journal of Physical Chemistry A 110 (26), 8181-8187, 2006
Topological analysis of the Fukui function
P Fuentealba, E Florez, W Tiznado
Journal of chemical theory and computation 6 (5), 1470-1478, 2010
A proposal for a new local hardness as selectivity index
L Meneses, W Tiznado, R Contreras, P Fuentealba
Chemical physics letters 383 (1-2), 181-187, 2004
Designing 3-D molecular stars
W Tiznado, N Perez-Peralta, R Islas, A Toro-Labbe, JM Ugalde, G Merino
Journal of the American Chemical Society 131 (26), 9426-9431, 2009
Comparison among four different ways to condense the Fukui function
W Tiznado, E Chamorro, R Contreras, P Fuentealba
The Journal of Physical Chemistry A 109 (14), 3220-3224, 2005
Study of the differential activity of thrombin inhibitors using docking, QSAR, molecular dynamics, and MM-GBSA
K Mena-Ulecia, W Tiznado, J Caballero
PLoS One 10 (11), e0142774, 2015
Minimizing the risk of reporting false aromaticity and antiaromaticity in inorganic heterocycles following magnetic criteria
JJ Torres-Vega, A Vásquez-Espinal, J Caballero, ML Valenzuela, ...
Inorganic Chemistry 53 (7), 3579-3585, 2014
Theoretical study of the interaction of molecular oxygen with copper clusters
E Florez, W Tiznado, F Mondragón, P Fuentealba
The Journal of Physical Chemistry A 109 (34), 7815-7821, 2005
Orbital-weighted dual descriptor for the study of local reactivity of systems with (quasi-) degenerate states
R Pino-Rios, D Inostroza, G Cárdenas-Jirón, W Tiznado
The Journal of Physical Chemistry A 123 (49), 10556-10562, 2019
Analysis of Why Boron Avoids sp2 Hybridization and Classical Structures in the BnHn+2 Series
E Osorio, JK Olson, W Tiznado, AI Boldyrev
Chemistry–A European Journal 18 (31), 9677-9681, 2012
The Fukui potential and the capacity of charge and the global hardness of atoms
C Cárdenas, W Tiznado, PW Ayers, P Fuentealba
The Journal of Physical Chemistry A 115 (11), 2325-2331, 2011
Isomerization Energy Decomposition Analysis for Highly Ionic Systems: Case Study of Starlike E5Li7+ Clusters
M Contreras, E Osorio, F Ferraro, G Puga, KJ Donald, JG Harrison, ...
Chemistry–A European Journal 19 (7), 2305-2310, 2013
Proposal of a simple and effective local reactivity descriptor through a topological analysis of an orbital‐weighted fukui function
R Pino‐Rios, O Yañez, D Inostroza, L Ruiz, C Cardenas, P Fuentealba, ...
Journal of Computational Chemistry 38 (8), 481-488, 2017
Theoretical study of the antioxidant activity of quercetin oxidation products
A Vásquez-Espinal, O Yañez, E Osorio, C Areche, O García-Beltrán, ...
Frontiers in Chemistry 7, 818, 2019
An analysis of the isomerization energies of 1, 2-/1, 3-diazacyclobutadiene, pyrazole/imidazole, and pyridazine/pyrimidine with the turn-upside-down approach
M El-Hamdi, W Tiznado, J Poater, M Solà
The Journal of Organic Chemistry 76 (21), 8913-8921, 2011
AUTOMATON: a program that combines a probabilistic cellular automata and a genetic algorithm for global minimum search of clusters and molecules
O Yañez, R Báez-Grez, D Inostroza, WA Rabanal-León, R Pino-Rios, ...
Journal of chemical theory and computation 15 (2), 1463-1475, 2019
Scalar and Spin−Orbit Relativistic Corrections to the NICS and the Induced Magnetic Field: The case of the E122− Spherenes (E = Ge, Sn, Pb)
AC Castro, E Osorio, JOC Jiménez-Halla, E Matito, W Tiznado, G Merino
Journal of Chemical Theory and Computation 6 (9), 2701-2705, 2010
Which NICS method is most consistent with ring current analysis? Assessment in simple monocycles
R Báez-Grez, L Ruiz, R Pino-Rios, W Tiznado
RSC advances 8 (24), 13446-13453, 2018
Stop rotating! One substitution halts the B 19− motor
F Cervantes-Navarro, G Martínez-Guajardo, E Osorio, D Moreno, ...
Chemical Communications 50 (73), 10680-10682, 2014
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