Works by Cortés‐Guzmán, Fernando

Results: 26

Choquet integral-based fuzzy molecular characterizations: when global definitions are computed from the dependency among atom/bond contributions (LOVIs/LOEIs).

Published in:

Journal of Cheminformatics, 2018, v. 10, n. 1, p. 1, doi. 10.1186/s13321-018-0306-7

By:

García-Jacas, César R.;
Cabrera-Leyva, Lisset;
Marrero-Ponce, Yovani;
Suárez-Lezcano, José;
Cortés-Guzmán, Fernando;
Pupo-Meriño, Mario;
Vivas-Reyes, Ricardo

Publication type:

Article

Latin American contributions to quantum chemical topology.

Published in:

International Journal of Quantum Chemistry, 2019, v. 119, n. 2, p. N.PAG, doi. 10.1002/qua.25789

By:

García‐Revilla, Marco A.;
Cortés‐Guzmán, Fernando;
Rocha‐Rinza, Tomás;
Hernández‐Trujillo, Jesús

Publication type:

Article

Do weak interactions affect the biological behavior of DNA? A DFT study of CpG island–like chains.

Published in:

Journal of Molecular Modeling, 2020, v. 26, n. 10, p. 1, doi. 10.1007/s00894-020-04501-6

By:

Gutiérrez-Flores, Jorge;
Hernández-Lemus, Enrique;
Cortés-Guzmán, Fernando;
Ramos, Estrella

Publication type:

Article

Intermediate Detection in the Casiopeina–Cysteine Interaction Ending in the Disulfide Bond Formation and Copper Reduction.

Published in:

Molecules, 2021, v. 26, n. 19, p. 5729, doi. 10.3390/molecules26195729

By:

Ramírez-Palma, Lillian G.;
Espinoza-Guillén, Adrián;
Nieto-Camacho, Fabiola;
López-Guerra, Alexis E.;
Gómez-Vidales, Virginia;
Cortés-Guzmán, Fernando;
Ruiz-Azuara, Lena

Publication type:

Article

GOWAWA Aggregation Operator‐based Global Molecular Characterizations: Weighting Atom/bond Contributions (LOVIs/LOEIs) According to their Influence in the Molecular Encoding.

Published in:

Molecular Informatics, 2018, v. 37, n. 12, p. N.PAG, doi. 10.1002/minf.201800039

By:

García‐Jacas, César R.;
Cabrera‐Leyva, Lisset;
Marrero‐Ponce, Yovani;
Suárez‐Lezcano, José;
Cortés‐Guzmán, Fernando;
García‐González, Luis A.

Publication type:

Article

Quantum Topological Atomic Properties of 44K molecules.

Published in:

Scientific Data, 2024, v. 11, n. 1, p. 1, doi. 10.1038/s41597-024-03723-0

By:

Meza-González, Brandon;
Ramírez-Palma, David I.;
Carpio-Martínez, Pablo;
Vázquez-Cuevas, David;
Martínez-Mayorga, Karina;
Cortés-Guzmán, Fernando

Publication type:

Article

Front Cover: Laplacian of the Hamiltonian Kinetic Energy Density as an Indicator of Binding and Weak Interactions (ChemPhysChem 3/2020).

Published in:

ChemPhysChem, 2020, v. 21, n. 3, p. 187, doi. 10.1002/cphc.202000035

By:

Carpio‐Martínez, Pablo;
Barquera‐Lozada, José E.;
Pendás, Angel Martín;
Cortés‐Guzmán, Fernando

Publication type:

Article

Laplacian of the Hamiltonian Kinetic Energy Density as an Indicator of Binding and Weak Interactions.

Published in:

ChemPhysChem, 2020, v. 21, n. 3, p. 194, doi. 10.1002/cphc.201900769

By:

Carpio‐Martínez, Pablo;
Barquera‐Lozada, José E.;
Pendás, Angel Martín;
Cortés‐Guzmán, Fernando

Publication type:

Article

The Role of the DNA Backbone in Minor-Groove Ligand Binding.

Published in:

ChemPhysChem, 2017, v. 18, n. 14, p. 1909, doi. 10.1002/cphc.201700260

By:

Díaz‐Gómez, Dalia G.;
Galindo‐Murillo, Rodrigo;
Cortés‐Guzmán, Fernando

Publication type:

Article

Energy additivity in branched and cyclic hydrocarbons.

Published in:

Canadian Journal of Chemistry, 2009, v. 87, n. 11, p. 1583, doi. 10.1139/V09-121

By:

Hongwei Gao;
Bader, Richard F. W.;
Cortés-Guzmán, Fernando

Publication type:

Article

Isomeric Effect on the Pharmacokinetic Behavior of Anticancer Cu<sup>II</sup> Mixed Chelate Complexes: Experimental and Theoretical Approach.

Published in:

European Journal of Inorganic Chemistry, 2017, v. 2017, n. 12, p. 1728, doi. 10.1002/ejic.201601199

By:

García‐Ramos, Juan Carlos;
Vértiz‐Serrano, Guadalupe;
Macías‐Rosales, Lucia;
Galindo‐Murillo, Rodrigo;
Toledano‐Magaña, Yanis;
Bernal, Juan Pablo;
Cortés‐Guzmán, Fernando;
Ruiz‐Azuara, Lena

Publication type:

Article

Where are the lone pairs? QC and QCT.

Published in:

Acta Crystallographica Section C: Structural Chemistry, 2025, v. 81, n. 2, p. 54, doi. 10.1107/S2053229624012488

By:

Cortés-Guzmán, Fernando

Publication type:

Article

An Examination of the Electron Densities in a Series of Tripodal Cobalt Complexes Bridged by Magnesium, Calcium, Strontium, and Barium †.

Published in:

Crystals (2073-4352), 2018, v. 8, n. 6, p. 234, doi. 10.3390/cryst8060234

By:

Bacsa, John;
Ramírez-Palma, Lillian G.;
Cortés-Guzmán, Fernando;
Wallen, Christian M.;
Scarborough, Christopher C.

Publication type:

Article

Erratum: Properties of Atoms in Electronically Excited Molecules Within the Formalism of TDDFT [J. ComputChem. 2014, 35, 820-828].

Published in:

Journal of Computational Chemistry, 2015, v. 36, n. 32, p. 2429, doi. 10.1002/jcc.24224

By:

Sánchez‐Flores, Eric Iván;
Chávez‐Calvillo, Rodrigo;
Keith, Todd A.;
Cuevas, Gabriel;
Rocha‐Rinza, Tomás;
Cortés‐Guzmán, Fernando

Publication type:

Article

The Role of Induced Current Density in Steroelectronic Effects: Perlin Effect.

Published in:

Journal of Computational Chemistry, 2015, v. 36, n. 21, p. 1573, doi. 10.1002/jcc.23965

By:

Hernández‐Lima, Joseelyne G.;
Barquera‐Lozada, Jose E.;
Cuevas, Gabriel;
Cortés‐Guzmán, Fernando

Publication type:

Article

Properties of atoms in electronically excited molecules within the formalism of TDDFT.

Published in:

Journal of Computational Chemistry, 2014, v. 35, n. 10, p. 820, doi. 10.1002/jcc.23559

By:

Sánchez‐Flores, Eric Iván;
Chávez‐Calvillo, Rodrigo;
Keith, Todd A.;
Cuevas, Gabriel;
Rocha‐Rinza, Tomás;
Cortés‐Guzmán, Fernando

Publication type:

Article

Distribution of toxicity values across different species and modes of action of pesticides from PESTIMEP and PPDB databases.

Published in:

Toxicology Research, 2019, v. 8, n. 2, p. 146, doi. 10.1039/c8tx00322j

By:

Madariaga-Mazón, Abraham;
Osnaya-Hernández, Adriana;
Chávez-Gómez, Arni;
García-Ramos, Juan Carlos;
Cortés-Guzmán, Fernando;
Castillo-Pazos, Durbis Javier;
Martínez-Mayorga, Karina

Publication type:

Article

Intercalation processes of copper complexes in DNA.

Published in:

Nucleic Acids Research, 2015, v. 43, n. 11, p. 5364, doi. 10.1093/nar/gkv467

By:

Galindo-Murillo, Rodrigo;
García-Ramos, Juan Carlos;
Ruiz-Azuara, Lena;
Cheatham III, Thomas E.;
Cortés-Guzmán, Fernando

Publication type:

Article

Is Hexachloro- cyclo-triphosphazene Aromatic? Evidence from Experimental Charge Density Analysis.

Published in:

Chemistry - A European Journal, 2017, v. 23, n. 29, p. 6964, doi. 10.1002/chem.201700411

By:

Jancik, Vojtech;
Cortés‐Guzmán, Fernando;
Herbst‐Irmer, Regine;
Matínez‐Otero, Diego

Publication type:

Article

Dynamic Molecular Graphs: 'Hopping' Structures.

Published in:

Chemistry - A European Journal, 2014, v. 20, n. 19, p. 5665, doi. 10.1002/chem.201303287

By:

Cortés ‐ Guzmán, Fernando;
Rocha ‐ Rinza, Tomas;
Guevara ‐ Vela, José Manuel;
Cuevas, Gabriel;
Gómez, Rosa María

Publication type:

Article

Frontispiece: Origin of the Photoinduced Geometrical Change of Copper(I) Complexes from the Quantum Chemical Topology View.

Published in:

2019

By:

Gutiérrez‐Arzaluz, Luis;
Ramírez‐Palma, David Ignacio;
Ramírez‐Palma, Lillian G.;
Barquera‐Lozada, José Enrique;
Peon, Jorge;
Cortés‐Guzmán, Fernando

Publication type:

Image

Origin of the Photoinduced Geometrical Change of Copper(I) Complexes from the Quantum Chemical Topology View.

Published in:

Chemistry - A European Journal, 2019, v. 25, n. 3, p. 775, doi. 10.1002/chem.201804596

By:

Gutiérrez‐Arzaluz, Luis;
Ramírez‐Palma, David Ignacio;
Ramírez‐Palma, Lillian G.;
Barquera‐Lozada, José Enrique;
Peon, Jorge;
Cortés‐Guzmán, Fernando

Publication type:

Article

Visualizing Correlation Regions: The Case of the Ammonia Crystal.

Published in:

Chemistry - Methods, 2022, v. 2, n. 2, p. 1, doi. 10.1002/cmtd.202100045

By:

Ramírez‐Palma, David;
Landeros‐Rivera, Bruno;
Genoni, Alessandro;
Cortés‐Guzmán, Fernando;
Contreras‐García, Julia

Publication type:

Article

Charge transfer and electron localization as the origin of the anomeric effect in the O─C─O segment of dimethoxymethane and spiroketals.

Published in:

Journal of Physical Organic Chemistry, 2018, v. 31, n. 4, p. 1, doi. 10.1002/poc.3793

By:

Buschbeck‐Alvarado, Martha E.;
Hernández‐Fernández, Gabriel;
Hernández‐Trujillo, Jesús;
Cortés‐Guzmán, Fernando;
Cuevas, Gabriel

Publication type:

Article

Theoretical study of the smiles rearrangement in the activation mechanism of proton pump inhibitors.

Published in:

Journal of Physical Organic Chemistry, 2012, v. 25, n. 3, p. 230, doi. 10.1002/poc.1896

By:

Reyes‐González, Jorge;
Gómez, Rosa María;
Cortés‐Guzmán, Fernando

Publication type:

Article

Electronic substituent effects in the electron impact mass spectrometry of 2-(arylazo)-4-phenylphenols.

Published in:

Rapid Communications in Mass Spectrometry: RCM, 2005, v. 19, n. 18, p. 2563, doi. 10.1002/rcm.2095

By:

Pérez-Caballero, Guadalupe;
Jiménez-Cruz, Federico;
Matamoros, Pablo Hernández;
García, José Guadalupe;
Cortés-Guzmán, Fernando;
Miranda, René

Publication type:

Article