Search research articles
Contact Us
Filters
Showing results (31-40 of 65) with videos related to
Page
of 7
Sort By:
Physical Chemistry Chemical Physics : PCCP
|
December 15, 2015
Towards the first theoretical scale of the trans effect in octahedral complexes
Frédéric Guégan, Vincent Tognetti, Laurent Joubert, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 2, 2018
Fluorine substituent effect on the stereochemistry of catalyzed and non-catalyzed Diels-Alder reactions. The case of R-butenone with cyclopentadiene: a computational assessment of the mechanism
Lynda Merzoud, Amar Saal, Ramdane Moussaoui, et al.
Nucleic Acids Research
|
March 24, 2017
Conformational polymorphism or structural invariance in DNA photoinduced lesions: implications for repair rates
François Dehez, Hugo Gattuso, Emmanuelle Bignon, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
May 15, 2024
Determining the Factors Accounting for Reaction Selectivity: A Relative Energy Gradient - Interacting Quantum Atoms and Natural Bonding Orbitals Study
Aël Cador, Christophe Morell, Vincent Tognetti, et al.
The Journal of Physical Chemistry. A
|
July 8, 2009
Chemical reactivity descriptors for ambiphilic reagents: dual descriptor, local hypersoftness, and electrostatic potential
Carlos Cárdenas, Nataly Rabi, Paul W Ayers, et al.
Physical Chemistry Chemical Physics : PCCP
|
December 9, 2008
Rationalization of Diels-Alder reactions through the use of the dual reactivity descriptor Deltaf(r)
Christophe Morell, Paul W Ayers, André Grand, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 12, 2015
Investigation of electron density changes at the onset of a chemical reaction using the state-specific dual descriptor from conceptual density functional theory
Frank De Proft, Valérian Forquet, Benjamin Ourri, et al.
The Journal of Physical Chemistry. A
|
June 4, 2011
Use of the dual potential to rationalize the occurrence of some DNA lesions (pyrimidic dimers)
Christophe Morell, Vanessa Labet, Paul W Ayers, et al.
Journal of Computational Chemistry
|
January 28, 2023
Understanding the mechanism and regio- and stereo selectivity of [3 + 2] cycloaddition reactions between substituted azomethine ylide and 3,3,3-trifluoro-1-nitroprop-1-ene, within the molecular electron density theory
Chafia Sobhi, Lynda Merzoud, Souad Bouasla, et al.
The Journal of Physical Chemistry. A
|
January 9, 2010
Hydrolytic deamination of 5,6-dihydrocytosine in a protic medium: a theoretical study
Vanessa Labet, Christophe Morell, Thierry Douki, et al.
Page
of 7
Search research articles
Search
Showing results (31-40 of 65) with videos related to
Sort By:
Page
of 7
Physical Chemistry Chemical Physics : PCCP
|
December 15, 2015
Towards the first theoretical scale of the trans effect in octahedral complexes
Frédéric Guégan, Vincent Tognetti, Laurent Joubert, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 2, 2018
Fluorine substituent effect on the stereochemistry of catalyzed and non-catalyzed Diels-Alder reactions. The case of R-butenone with cyclopentadiene: a computational assessment of the mechanism
Lynda Merzoud, Amar Saal, Ramdane Moussaoui, et al.
Nucleic Acids Research
|
March 24, 2017
Conformational polymorphism or structural invariance in DNA photoinduced lesions: implications for repair rates
François Dehez, Hugo Gattuso, Emmanuelle Bignon, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
May 15, 2024
Determining the Factors Accounting for Reaction Selectivity: A Relative Energy Gradient - Interacting Quantum Atoms and Natural Bonding Orbitals Study
Aël Cador, Christophe Morell, Vincent Tognetti, et al.
The Journal of Physical Chemistry. A
|
July 8, 2009
Chemical reactivity descriptors for ambiphilic reagents: dual descriptor, local hypersoftness, and electrostatic potential
Carlos Cárdenas, Nataly Rabi, Paul W Ayers, et al.
Physical Chemistry Chemical Physics : PCCP
|
December 9, 2008
Rationalization of Diels-Alder reactions through the use of the dual reactivity descriptor Deltaf(r)
Christophe Morell, Paul W Ayers, André Grand, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 12, 2015
Investigation of electron density changes at the onset of a chemical reaction using the state-specific dual descriptor from conceptual density functional theory
Frank De Proft, Valérian Forquet, Benjamin Ourri, et al.
The Journal of Physical Chemistry. A
|
June 4, 2011
Use of the dual potential to rationalize the occurrence of some DNA lesions (pyrimidic dimers)
Christophe Morell, Vanessa Labet, Paul W Ayers, et al.
Journal of Computational Chemistry
|
January 28, 2023
Understanding the mechanism and regio- and stereo selectivity of [3 + 2] cycloaddition reactions between substituted azomethine ylide and 3,3,3-trifluoro-1-nitroprop-1-ene, within the molecular electron density theory
Chafia Sobhi, Lynda Merzoud, Souad Bouasla, et al.
The Journal of Physical Chemistry. A
|
January 9, 2010
Hydrolytic deamination of 5,6-dihydrocytosine in a protic medium: a theoretical study
Vanessa Labet, Christophe Morell, Thierry Douki, et al.
Page
of 7