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- Currently displaying 21461 - 21480 of 29681 publications
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
Lithium MAS NMR studies of cathode materials for lithium-ion batteries
Solid State Sciences
(2003)
5
{883-894}
Two-dimensional Hadamard spectroscopy.
Journal of Magnetic Resonance
(2003)
162
300
6Li MAS NMR and in situ X-ray studies of lithium nickel manganese oxides
Journal of Power Sources
(2003)
119
{649-653}
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)
Adsorption of HF and HCl molecules on ice at 190 and 235 K from molecular dynamics simulations: Free energy profiles and residence times
The Journal of Chemical Physics
(2003)
118
9814
(doi: 10.1063/1.1570408)
Experiences with the shikimate-pathway enzymes as targets for rational drug design
Biochem Soc Trans
(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 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
Physical Review Letters
(2003)
90
4
Solving the phase problem for carbohydrate-binding proteins using selenium derivatives of their ligands: a case study involving the bacterial F17-G adhesin
Acta Crystallographica Section D Biological Crystallography
(2003)
59
1012
(doi: 10.1107/S0907444903007170)
Numerical calculation of the melting phase diagram of low molecular-weight polyethylene
Journal of Chemical Physics
(2003)
118
9433
(doi: 10.1063/1.1568934)
On the representation of potential energy surfaces of polyatomic molecules in normal coordinates: II. Parameterisation of the force field
Chemical Physics Letters
(2003)
373
357
Versatile solid-phase synthesis of secondary amines from alcohols. Development of an N-Boc-(o-nitrobenzene)sulfonamide linker
Tetrahedron Letters
(2003)
44
4153
Velocity fluctuations and dispersion in a simple porous medium
Physical Review E
(2003)
67
8
(doi: 10.1103/physreve.67.056306)
Nonmonotonic variation with salt concentration of the second virial coefficient in protein solutions - art. no. 051404
Phys Rev E Stat Nonlin Soft Matter Phys
(2003)
67
051404
(doi: 10.1103/PhysRevE.67.051404)
Towards the chemical semantic web. An introduction to RSS
INTERNET J CHEM
(2003)
6
4