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The Journal of Physical Chemistry. A
|
September 29, 2006
Experimental and density functional theory study of the vibrational properties of 2-mercaptobenzimidazole in interaction with gold
Th Doneux, F Tielens, P Geerlings, et al.
The Journal of Chemical Physics
|
June 24, 2010
Nonuniqueness of magnetic fields and energy derivatives in spin-polarized density functional theory
T Gál, P W Ayers, F De Proft, et al.
The Journal of Chemical Physics
|
June 30, 2007
Quantum similarity study of atoms: a bridge between hardness and similarity indices
A Borgoo, M Torrent-Sucarrat, F De Proft, et al.
Journal of Chemical Theory and Computation
|
December 3, 2015
Influence of Stacking on the Hydrogen Bond Donating Potential of Nucleic Bases
K Vanommeslaeghe, P Mignon, S Loverix, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 1, 2008
Influence of confinement on atomic and molecular reactivity indicators in DFT
A Borgoo, D J Tozer, P Geerlings, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 28, 2011
A new approach to local hardness
T Gál, P Geerlings, F De Proft, et al.
Journal of Substance Abuse Treatment
|
January 1, 1989
The Addiction Severity Index: reliability and validity in a Dutch addict population
V M Hendriks, C D Kaplan, J van Limbeek, et al.
Bioorganic & Medicinal Chemistry
|
May 10, 2005
Theoretical study revealing the functioning of a novel combination of catalytic motifs in histone deacetylase
K Vanommeslaeghe, F De Proft, S Loverix, et al.
The Journal of Chemical Physics
|
February 9, 2007
Quantum similarity study of atomic density functions: insights from information theory and the role of relativistic effects
A Borgoo, M Godefroid, P Indelicato, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 11, 2014
Atomic electron affinities and the role of symmetry between electron addition and subtraction in a corrected Koopmans approach
A M Teale, F De Proft, P Geerlings, et al.
Page
of 6
Search research articles
Search
Showing results (21-30 of 54) with videos related to
Sort By:
Page
of 6
The Journal of Physical Chemistry. A
|
September 29, 2006
Experimental and density functional theory study of the vibrational properties of 2-mercaptobenzimidazole in interaction with gold
Th Doneux, F Tielens, P Geerlings, et al.
The Journal of Chemical Physics
|
June 24, 2010
Nonuniqueness of magnetic fields and energy derivatives in spin-polarized density functional theory
T Gál, P W Ayers, F De Proft, et al.
The Journal of Chemical Physics
|
June 30, 2007
Quantum similarity study of atoms: a bridge between hardness and similarity indices
A Borgoo, M Torrent-Sucarrat, F De Proft, et al.
Journal of Chemical Theory and Computation
|
December 3, 2015
Influence of Stacking on the Hydrogen Bond Donating Potential of Nucleic Bases
K Vanommeslaeghe, P Mignon, S Loverix, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 1, 2008
Influence of confinement on atomic and molecular reactivity indicators in DFT
A Borgoo, D J Tozer, P Geerlings, et al.
Physical Chemistry Chemical Physics : PCCP
|
July 28, 2011
A new approach to local hardness
T Gál, P Geerlings, F De Proft, et al.
Journal of Substance Abuse Treatment
|
January 1, 1989
The Addiction Severity Index: reliability and validity in a Dutch addict population
V M Hendriks, C D Kaplan, J van Limbeek, et al.
Bioorganic & Medicinal Chemistry
|
May 10, 2005
Theoretical study revealing the functioning of a novel combination of catalytic motifs in histone deacetylase
K Vanommeslaeghe, F De Proft, S Loverix, et al.
The Journal of Chemical Physics
|
February 9, 2007
Quantum similarity study of atomic density functions: insights from information theory and the role of relativistic effects
A Borgoo, M Godefroid, P Indelicato, et al.
Physical Chemistry Chemical Physics : PCCP
|
January 11, 2014
Atomic electron affinities and the role of symmetry between electron addition and subtraction in a corrected Koopmans approach
A M Teale, F De Proft, P Geerlings, et al.
Page
of 6