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Inorganic Chemistry
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December 10, 2002
Does back-bonding involve bonding orbitals in boryl complexes? A theoretical DFT study
Géraldine Sivignon, Paul Fleurat-Lessard, Jean-Marie Onno, et al.
The Journal of Physical Chemistry. A
|
July 15, 2006
Optimizing the structures of minimum and transition state on the free energy surface
Sheng-Yong Yang, Iordan Hristov, Paul Fleurat-Lessard, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 25, 2011
Evidences for the key role of hydrogen bonds in nucleophilic aromatic substitution reactions
Nicolas Chéron, Laurent El Kaïm, Laurence Grimaud, et al.
The Journal of Physical Chemistry. A
|
July 27, 2011
A density functional theory study of the Nef-isocyanide reaction: mechanism, influence of parameters and scope
Nicolas Chéron, Laurent El Kaïm, Laurence Grimaud, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Multiscale Modeling of Chemistry in Water: Are We There Yet?
Rosa E Bulo, Carine Michel, Paul Fleurat-Lessard, et al.
Journal of Chemical Theory and Computation
|
May 16, 2020
Ten Facets, One Force Field: The GAL19 Force Field for Water-Noble Metal Interfaces
Paul Clabaut, Paul Fleurat-Lessard, Carine Michel, et al.
The Journal of Physical Chemistry. A
|
July 27, 2013
Substituent effects in Ugi-smiles reactions
Nicolas Chéron, Romain Ramozzi, Laurent El Kaïm, et al.
The Journal of Organic Chemistry
|
January 10, 2012
Challenging 50 years of established views on Ugi reaction: a theoretical approach
Nicolas Chéron, Romain Ramozzi, Laurent El Kaïm, et al.
The Journal of Physical Chemistry. B
|
April 13, 2010
Free energy calculations: an efficient adaptive biasing potential method
Bradley M Dickson, Frédéric Legoll, Tony Lelièvre, et al.
The Journal of Organic Chemistry
|
January 18, 2008
Trimerization products of trifluoroacetone: critical solvent effect on position and kinetics of anomeric equilibria
Pierre-Loïc Saaidi, Mathieu Guyonnet, Erwann Jeanneau, et al.
Page
of 7
Search research articles
Search
Showing results (11-20 of 62) with videos related to
Sort By:
Page
of 7
Inorganic Chemistry
|
December 10, 2002
Does back-bonding involve bonding orbitals in boryl complexes? A theoretical DFT study
Géraldine Sivignon, Paul Fleurat-Lessard, Jean-Marie Onno, et al.
The Journal of Physical Chemistry. A
|
July 15, 2006
Optimizing the structures of minimum and transition state on the free energy surface
Sheng-Yong Yang, Iordan Hristov, Paul Fleurat-Lessard, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
November 25, 2011
Evidences for the key role of hydrogen bonds in nucleophilic aromatic substitution reactions
Nicolas Chéron, Laurent El Kaïm, Laurence Grimaud, et al.
The Journal of Physical Chemistry. A
|
July 27, 2011
A density functional theory study of the Nef-isocyanide reaction: mechanism, influence of parameters and scope
Nicolas Chéron, Laurent El Kaïm, Laurence Grimaud, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Multiscale Modeling of Chemistry in Water: Are We There Yet?
Rosa E Bulo, Carine Michel, Paul Fleurat-Lessard, et al.
Journal of Chemical Theory and Computation
|
May 16, 2020
Ten Facets, One Force Field: The GAL19 Force Field for Water-Noble Metal Interfaces
Paul Clabaut, Paul Fleurat-Lessard, Carine Michel, et al.
The Journal of Physical Chemistry. A
|
July 27, 2013
Substituent effects in Ugi-smiles reactions
Nicolas Chéron, Romain Ramozzi, Laurent El Kaïm, et al.
The Journal of Organic Chemistry
|
January 10, 2012
Challenging 50 years of established views on Ugi reaction: a theoretical approach
Nicolas Chéron, Romain Ramozzi, Laurent El Kaïm, et al.
The Journal of Physical Chemistry. B
|
April 13, 2010
Free energy calculations: an efficient adaptive biasing potential method
Bradley M Dickson, Frédéric Legoll, Tony Lelièvre, et al.
The Journal of Organic Chemistry
|
January 18, 2008
Trimerization products of trifluoroacetone: critical solvent effect on position and kinetics of anomeric equilibria
Pierre-Loïc Saaidi, Mathieu Guyonnet, Erwann Jeanneau, et al.
Page
of 7