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Physical Chemistry Chemical Physics : PCCP
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June 23, 2011
Non-conventional hydrogen bonds: pterins-metal anions
Rubicelia Vargas, Ana Martínez
Frontiers in Chemistry
|
June 23, 2025
Non-covalent interactions in MOFs: a quantum approach to gas adsorption and molecular encapsulation
Erika Medel, Rubicelia Vargas
The Journal of Physical Chemistry. B
|
September 23, 2011
Free radical scavenger properties of α-mangostin: thermodynamics and kinetics of HAT and RAF mechanisms
Ana Martínez, Annia Galano, Rubicelia Vargas
The Journal of Physical Chemistry. B
|
August 1, 2009
What is important to prevent oxidative stress? A theoretical study on electron-transfer reactions between carotenoids and free radicals
Ana Martínez, Rubicelia Vargas, Annia Galano
The Journal of Physical Chemistry. A
|
July 13, 2006
Koopmans-like approximation in the Kohn-Sham method and the impact of the frozen core approximation on the computation of the reactivity parameters of the density functional theory
Rubicelia Vargas, Jorge Garza, Andrés Cedillo
Physical Chemistry Chemical Physics : PCCP
|
December 22, 2009
Carotenoids can act as antioxidants by oxidizing the superoxide radical anion
Annia Galano, Rubicelia Vargas, Ana Martínez
Plos One
|
December 13, 2019
A quantum chemical approach representing a new perspective concerning agonist and antagonist drugs in the context of schizophrenia and Parkinson's disease
Ana Martínez, Ilich A Ibarra, Rubicelia Vargas
Physical Chemistry Chemical Physics : PCCP
|
November 29, 2011
The role of conformational changes in the signal enhancement of a selective chemosensor of Pb2+
José-Zeferino Ramírez, Rubicelia Vargas, Jorge Garza
The Journal of Physical Chemistry. A
|
July 13, 2006
Role of Hartree-Fock and Kohn-Sham orbitals in the basis set superposition error for systems linked by hydrogen bonds
Jorge Garza, José-Zeferino Ramírez, Rubicelia Vargas
The Journal of Chemical Physics
|
March 19, 2008
The Kohn-Sham kinetic energy density as indicator of the electron localization: atomic shell structure
Alejandra M Navarrete-López, Jorge Garza, Rubicelia Vargas
Page
of 5
Search research articles
Search
Showing results (1-10 of 49) with videos related to
Sort By:
Page
of 5
Physical Chemistry Chemical Physics : PCCP
|
June 23, 2011
Non-conventional hydrogen bonds: pterins-metal anions
Rubicelia Vargas, Ana Martínez
Frontiers in Chemistry
|
June 23, 2025
Non-covalent interactions in MOFs: a quantum approach to gas adsorption and molecular encapsulation
Erika Medel, Rubicelia Vargas
The Journal of Physical Chemistry. B
|
September 23, 2011
Free radical scavenger properties of α-mangostin: thermodynamics and kinetics of HAT and RAF mechanisms
Ana Martínez, Annia Galano, Rubicelia Vargas
The Journal of Physical Chemistry. B
|
August 1, 2009
What is important to prevent oxidative stress? A theoretical study on electron-transfer reactions between carotenoids and free radicals
Ana Martínez, Rubicelia Vargas, Annia Galano
The Journal of Physical Chemistry. A
|
July 13, 2006
Koopmans-like approximation in the Kohn-Sham method and the impact of the frozen core approximation on the computation of the reactivity parameters of the density functional theory
Rubicelia Vargas, Jorge Garza, Andrés Cedillo
Physical Chemistry Chemical Physics : PCCP
|
December 22, 2009
Carotenoids can act as antioxidants by oxidizing the superoxide radical anion
Annia Galano, Rubicelia Vargas, Ana Martínez
Plos One
|
December 13, 2019
A quantum chemical approach representing a new perspective concerning agonist and antagonist drugs in the context of schizophrenia and Parkinson's disease
Ana Martínez, Ilich A Ibarra, Rubicelia Vargas
Physical Chemistry Chemical Physics : PCCP
|
November 29, 2011
The role of conformational changes in the signal enhancement of a selective chemosensor of Pb2+
José-Zeferino Ramírez, Rubicelia Vargas, Jorge Garza
The Journal of Physical Chemistry. A
|
July 13, 2006
Role of Hartree-Fock and Kohn-Sham orbitals in the basis set superposition error for systems linked by hydrogen bonds
Jorge Garza, José-Zeferino Ramírez, Rubicelia Vargas
The Journal of Chemical Physics
|
March 19, 2008
The Kohn-Sham kinetic energy density as indicator of the electron localization: atomic shell structure
Alejandra M Navarrete-López, Jorge Garza, Rubicelia Vargas
Page
of 5