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- Currently displaying 21381 - 21400 of 29614 publications
A simulation study of vibrational relaxation of I-3(-) in liquids
Molecular Physics
(2003)
101
1641
(doi: 10.1080/0026897031000078685)
Dynamic pruned-enriched Rosenbluth method
Molecular Physics
(2003)
101
1675
(doi: 10.1080/0026897031000094461)
Lattice-model study of the thermodynamic interplay of polymer crystallization and liquid–liquid demixing
Journal of Chemical Physics
(2003)
118
10343
(doi: 10.1063/1.1572462)
A Total Synthesis of Epothilones Using SolidāSupported Reagents and Scavengers
Angewandte Chemie (International ed. in English)
(2003)
42
2521
(doi: 10.1002/anie.200351413)
Why are aromatic compounds more soluble than aliphatic compounds in dimethylimidazolium ionic liquids? A simulation study
Chemical Physics Letters
(2003)
374
85
Ab initio study of rearrangements between C-60 fullerenes
Chemical Physics Letters
(2003)
374
125
Potent new heterogeneous asymmetric catalysts
Helvetica Chimica Acta
(2003)
86
1753
(doi: 10.1002/hlca.200390145)
The Development of a Practical Total Synthesis of Discodermolide, a Promising MicrotubuleāStabilizing Anticancer Agent
European Journal of Organic Chemistry
(2003)
2003
2193
(doi: 10.1002/ejoc.200300061)
Lithium MAS NMR studies of cathode materials for lithium-ion batteries
Solid State Sciences
(2003)
5
{883-894}
Vibrational spectra of furan, pyrrole, and thiophene from a density functional theory anharmonic force field.
Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy
(2003)
59
1881
Li-6 MAS NMR and in situ X-ray studies of lithium nickel manganese oxides
Journal of Power Sources
(2003)
119
{649-653}
Two-dimensional Hadamard spectroscopy
Journal of Magnetic Resonance
(2003)
162
300
Fluid–fluid coexistence in colloidal systems with short-ranged strongly directional attraction
The Journal of Chemical Physics
(2003)
118
9882
(doi: 10.1063/1.1569473)
Experiences with the shikimate-pathway enzymes as targets for rational drug design
Biochemical Society transactions
(2003)
31
548
(doi: 10.1042/BST0310548)
Structural insights into the evolution of the pantothenate-biosynthesis pathway
Biochem Soc Trans
(2003)
31
563
(doi: 10.1042/BST0310563)
Adsorption of HF and HCl molecules on ice at 190 and 235 K from molecular dynamics simulations: Free energy profiles and residence times
Journal of Chemical Physics
(2003)
118
9814
(doi: 10.1063/1.1570408)
Adsorption energies and geometries of phenol on the (111) surface of nickel: Anab initiostudy
Physical Review B Condensed Matter and Materials Physics
(2003)
67
193406
(doi: 10.1103/physrevb.67.193406)
Fluorinated Silane Self-Assembled Monolayers as Resists for Patterning Indium Tin Oxide
Langmuir
(2003)
19
5273
(doi: 10.1021/la0342114)
A quantitative parameter for predicting mixing behaviour in adsorbed layers: The 2D isomorphism coefficient
Chemical Physics Letters
(2003)
373
480
General Model for Water Monomer Adsorption on Close-Packed Transition and Noble Metal Surfaces
Phys Rev Lett
(2003)
90
2161021