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Zárate-Hernández, Luis A.
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1

Conceptual DFT, machine learning and molecular docking as t..:

Rangel-Peña, Uriel J. ; Zárate-Hernández, Luis A. ; Camacho-Mendoza, Rosa L....
Journal of Molecular Modeling.  29 (2023)  7 - p. , 2023
Link: https://doi.org/10.1007/..
 
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2

The use of global and local reactivity descriptors of conce..:

Ramírez-Martínez, Cinthia ; Zárate-Hernández, Luis A. ; Camacho-Mendoza, Rosa L....
Computational and Theoretical Chemistry.  1226 (2023)  - p. 114211 , 2023
Link: https://doi.org/10.1016/..
 
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3

QSTR Modeling to Find Relevant DFT Descriptors Related to t..:

Acosta-Jiménez, Emma H. ; Zárate-Hernández, Luis A. ; Camacho-Mendoza, Rosa L....
Molecules.  27 (2022)  17 - p. 5530 , 2022
Link: https://doi.org/10.3390/..
 
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4

A DFT Study of the Reaction of Acrylamide with L-Cysteine a..:

Ramirez-Montes, Sandra ; Zárate-Hernández, Luis A. ; Rodriguez, Jose A...
Molecules.  27 (2022)  23 - p. 8220 , 2022
Link: https://doi.org/10.3390/..
 
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5

On the interaction of anisole and thioanisole derivatives w..:

Camacho-Mendoza, Rosa L. ; Zárate-Hernández, Luis A. ; Vásquez-Pérez, José M....
Computational and Theoretical Chemistry.  1126 (2018)  - p. 54-64 , 2018
Link: https://doi.org/10.1016/..
 
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6

Estudio del mecanismo para obtener metanol a partir de CO:

Reyes-Zambrano, Angelly ; Zárate-Hernández, Luis Ángel ; Cruz-Borbolla, Julián...
Pädi Boletín Científico de Ciencias Básicas e Ingenierías del ICBI.  11 (2023)  21 - p. 43-49 , 2023
Link: https://doi.org/10.29057..
 
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7

A Practical Algorithm to Solve the Near-Congruence Problem ..:

Vásquez-Pérez, José Manuel ; Zárate-Hernández, Luis Ángel ; Gómez-Castro, Carlos Zepactonal.
Journal of Chemical Information and Modeling.  63 (2023)  4 - p. 1157-1165 , 2023
Link: https://doi.org/10.1021/..
 
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8

Assessment of Simultaneous Global Optimization of Geometry ..:

Zárate-Hernández, Luis Ángel ; Vásquez-Pérez, José Manuel ; Cruz-Borbolla, Julián
Journal of Chemical Theory and Computation.  18 (2022)  7 - p. 4565-4573 , 2022
Link: https://doi.org/10.1021/..
 
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9

New QSPR model for prediction of corrosion inhibition using..:

Camacho-Mendoza, Rosa L. ; Feria, Leticia ; Zárate-Hernández, Luis Ángel..
Journal of Molecular Modeling.  28 (2022)  8 - p. , 2022
Link: https://doi.org/10.1007/..
 
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10

Synthesis and characterization of organopalladium(II) compl..:

Alvarez-Hernández, Jesús-Alberto ; Andrade-López, Noemí ; Alvarado-Rodríguez, José G....
Polyhedron.  214 (2022)  - p. 115635 , 2022
Link: https://doi.org/10.1016/..
 
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11

Mechanosynthesis of Photochromic Oligophenyleneimines: Opti..:

Amado-Briseño, Miguel Angel ; Zárate-Hernández, Luis Ángel ; Alemán-Ayala, Karina...
Molecules.  24 (2019)  5 - p. 849 , 2019
Link: https://doi.org/10.3390/..
 
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12

QSTR Modeling to Find Relevant DFT Descriptors Related to t..:

Acosta-Jiménez, Emma H ; Zárate-Hernández, Luis A ; Camacho-Mendoza, Rosa L...
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC9457808/.  , 2022
Link: http://www.ncbi.nlm.nih...
 
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13

A DFT Study of the Reaction of Acrylamide with L-Cysteine a..:

Ramirez-Montes, Sandra ; Zárate-Hernández, Luis A ; Rodriguez, Jose A..
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC9736526/.  , 2022
Link: http://www.ncbi.nlm.nih...
 
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14

The chemical reactivity and QSPR of organic compounds appli..:

Zárate Hernández, Luis A. ; Camacho-Mendoza, Rosa L. ; González-Montiel, Simplicio.
Journal of Molecular Graphics and Modelling.  104 (2021)  - p. 107852 , 2021
Link: https://doi.org/10.1016/..
 
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15

A mechanistic study for obtaining methanol from CO ; Estudi..:

Reyes-Zambrano, Angelly ; Zárate-Hernández, Luis Ángel ; Cruz-Borbolla, Julián...
https://repository.uaeh.edu.mx/revistas/index.php/icbi/article/view/10313/10032.  , 2023
Link: https://repository.uaeh...
 
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