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Journal of Molecular Graphics
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August 1, 1996
The STATIS method: characterization of conformational states of flexible molecules from molecular dynamics simulations in solution
R Coquet, L Troxler, G Wipff
Physical Chemistry Chemical Physics : PCCP
|
April 14, 2007
Synergistic effect of dicarbollide anions in liquid-liquid extraction: a molecular dynamics study at the octanol-water interface
G Chevrot, R Schurhammer, G Wipff
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
January 5, 2001
Halide anion recognition in water by a hexaprotonated octaaza-cryptand: a molecular dynamics investigation
P Jost, R Schurhammer, G Wipff
Proceedings of the National Academy of Sciences of the United States of America
|
February 1, 1986
Theoretical calculation of relative binding affinity in host-guest systems
T P Lybrand, J A McCammon, G Wipff
Physical Chemistry Chemical Physics : PCCP
|
January 10, 2008
Conformational and Cs+ complexation properties of norbadione-A: a molecular modeling study
R Schurhammer, R Diss, B Spiess, et al.
Journal of Chemical Information and Computer Sciences
|
July 23, 2002
Assessment of the macrocyclic effect for the complexation of crown-ethers with alkali cations using the Substructural Molecular Fragments method
A Varnek, G Wipff, V P Solov'ev, et al.
Inorganic Chemistry
|
October 24, 2001
Interaction of M(3+) Lanthanide Cations with Amide, Pyridine, and Phosphoryl O=PPh(3) Ligands: A Quantum Mechanics Study
F. Berny, N. Muzet, L. Troxler, et al.
Inorganic Chemistry
|
May 17, 2007
Uranyl coordination in ionic liquids: the competition between ionic liquid anions, uranyl counterions, and Cl- anions investigated by extended X-ray absorption fine structure and UV-visible spectroscopies and molecular dynamics simulations
C Gaillard, A Chaumont, I Billard, et al.
Inorganic Chemistry
|
June 19, 2010
Competitive complexation of nitrates and chlorides to uranyl in a room temperature ionic liquid
C Gaillard, A Chaumont, I Billard, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 15, 2012
Acid extraction to a hydrophobic ionic liquid: the role of added tributylphosphate investigated by experiments and simulations
C Gaillard, V Mazan, S Georg, et al.
Page
of 4
Search research articles
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Showing results (21-30 of 32) with videos related to
Sort By:
Page
of 4
Journal of Molecular Graphics
|
August 1, 1996
The STATIS method: characterization of conformational states of flexible molecules from molecular dynamics simulations in solution
R Coquet, L Troxler, G Wipff
Physical Chemistry Chemical Physics : PCCP
|
April 14, 2007
Synergistic effect of dicarbollide anions in liquid-liquid extraction: a molecular dynamics study at the octanol-water interface
G Chevrot, R Schurhammer, G Wipff
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
January 5, 2001
Halide anion recognition in water by a hexaprotonated octaaza-cryptand: a molecular dynamics investigation
P Jost, R Schurhammer, G Wipff
Proceedings of the National Academy of Sciences of the United States of America
|
February 1, 1986
Theoretical calculation of relative binding affinity in host-guest systems
T P Lybrand, J A McCammon, G Wipff
Physical Chemistry Chemical Physics : PCCP
|
January 10, 2008
Conformational and Cs+ complexation properties of norbadione-A: a molecular modeling study
R Schurhammer, R Diss, B Spiess, et al.
Journal of Chemical Information and Computer Sciences
|
July 23, 2002
Assessment of the macrocyclic effect for the complexation of crown-ethers with alkali cations using the Substructural Molecular Fragments method
A Varnek, G Wipff, V P Solov'ev, et al.
Inorganic Chemistry
|
October 24, 2001
Interaction of M(3+) Lanthanide Cations with Amide, Pyridine, and Phosphoryl O=PPh(3) Ligands: A Quantum Mechanics Study
F. Berny, N. Muzet, L. Troxler, et al.
Inorganic Chemistry
|
May 17, 2007
Uranyl coordination in ionic liquids: the competition between ionic liquid anions, uranyl counterions, and Cl- anions investigated by extended X-ray absorption fine structure and UV-visible spectroscopies and molecular dynamics simulations
C Gaillard, A Chaumont, I Billard, et al.
Inorganic Chemistry
|
June 19, 2010
Competitive complexation of nitrates and chlorides to uranyl in a room temperature ionic liquid
C Gaillard, A Chaumont, I Billard, et al.
Physical Chemistry Chemical Physics : PCCP
|
March 15, 2012
Acid extraction to a hydrophobic ionic liquid: the role of added tributylphosphate investigated by experiments and simulations
C Gaillard, V Mazan, S Georg, et al.
Page
of 4