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Physical Chemistry Chemical Physics : PCCP
|
June 23, 2021
Main interactions of dopamine and risperidone with the dopamine D2 receptor
Ana Martínez, Ponciano García-Gutiérrez, Rafael A Zubillaga, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 6, 2016
Hydrogen bonds in methane-water clusters
Juan-Ramón Salazar-Cano, Alfredo Guevara-García, Rubicelia Vargas, et al.
Journal of Chemical Information and Modeling
|
May 31, 2019
Implementation of the Molecular Electrostatic Potential over Graphics Processing Units
J César Cruz, Raymundo Hernández-Esparza, Álvaro Vázquez-Mayagoitia, et al.
Journal of Molecular Modeling
|
July 4, 2018
Coordination numbers in hydrated Cu(II) ions
Alejandra Monjaraz-Rodríguez, Mariano Rodriguez-Bautista, Jorge Garza, et al.
Journal of Molecular Modeling
|
June 18, 2018
Analyzing ZnO clusters through the density-functional theory
Irineo-Pedro Zaragoza, Luis-Antonio Soriano-Agueda, Raymundo Hernández-Esparza, et al.
The Journal of Chemical Physics
|
July 24, 2015
Roothaan's approach to solve the Hartree-Fock equations for atoms confined by soft walls: Basis set with correct asymptotic behavior
Mariano Rodriguez-Bautista, Cecilia Díaz-García, Alejandra M Navarrete-López, et al.
Talanta
|
December 17, 2008
Dimerization of thymol blue in solution: Theoretical evidence
Patricia Balderas-Hernández, Rubicelia Vargas, Alberto Rojas-Hernández, et al.
Journal of the American Chemical Society
|
June 24, 2004
Structural criteria for the rational design of selective ligands: convergent hydrogen bonding sites for the nitrate anion
Benjamin P Hay, Maciej Gutowski, David A Dixon, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 25, 2017
Study of antiradical mechanisms with dihydroxybenzenes using reaction force and reaction electronic flux
Cristina Ortega-Moo, Rocio Durán, Bárbara Herrera, et al.
Computational and Structural Biotechnology Journal
|
August 17, 2021
Non-conventional interactions of N3 inhibitor with the main protease of SARS-CoV and SARS-CoV-2
Ponciano García-Gutiérrez, Rafael A Zubillaga, Ilich A Ibarra, et al.
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of 5
Search research articles
Search
Showing results (21-30 of 49) with videos related to
Sort By:
Page
of 5
Physical Chemistry Chemical Physics : PCCP
|
June 23, 2021
Main interactions of dopamine and risperidone with the dopamine D2 receptor
Ana Martínez, Ponciano García-Gutiérrez, Rafael A Zubillaga, et al.
Physical Chemistry Chemical Physics : PCCP
|
August 6, 2016
Hydrogen bonds in methane-water clusters
Juan-Ramón Salazar-Cano, Alfredo Guevara-García, Rubicelia Vargas, et al.
Journal of Chemical Information and Modeling
|
May 31, 2019
Implementation of the Molecular Electrostatic Potential over Graphics Processing Units
J César Cruz, Raymundo Hernández-Esparza, Álvaro Vázquez-Mayagoitia, et al.
Journal of Molecular Modeling
|
July 4, 2018
Coordination numbers in hydrated Cu(II) ions
Alejandra Monjaraz-Rodríguez, Mariano Rodriguez-Bautista, Jorge Garza, et al.
Journal of Molecular Modeling
|
June 18, 2018
Analyzing ZnO clusters through the density-functional theory
Irineo-Pedro Zaragoza, Luis-Antonio Soriano-Agueda, Raymundo Hernández-Esparza, et al.
The Journal of Chemical Physics
|
July 24, 2015
Roothaan's approach to solve the Hartree-Fock equations for atoms confined by soft walls: Basis set with correct asymptotic behavior
Mariano Rodriguez-Bautista, Cecilia Díaz-García, Alejandra M Navarrete-López, et al.
Talanta
|
December 17, 2008
Dimerization of thymol blue in solution: Theoretical evidence
Patricia Balderas-Hernández, Rubicelia Vargas, Alberto Rojas-Hernández, et al.
Journal of the American Chemical Society
|
June 24, 2004
Structural criteria for the rational design of selective ligands: convergent hydrogen bonding sites for the nitrate anion
Benjamin P Hay, Maciej Gutowski, David A Dixon, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 25, 2017
Study of antiradical mechanisms with dihydroxybenzenes using reaction force and reaction electronic flux
Cristina Ortega-Moo, Rocio Durán, Bárbara Herrera, et al.
Computational and Structural Biotechnology Journal
|
August 17, 2021
Non-conventional interactions of N3 inhibitor with the main protease of SARS-CoV and SARS-CoV-2
Ponciano García-Gutiérrez, Rafael A Zubillaga, Ilich A Ibarra, et al.
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of 5