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  • Currently displaying 20881 - 20900 of 29680 publications
Author(s)
Publication title
Journal Name
Publication year
Field-evaporation from first-principles
CGS *, AY lozovoi, A alavi
Molecular Physics
(2004)
102
Transferable polarizabilities for the alkanes
GJ Williams, AJS *
Molecular Physics
(2004)
102
Linear screening of the electrostatic potential around spherical particles with non-spherical charge patterns
N Hoffmann, CNL *, J-P Hansen
Molecular Physics
(2004)
102
Dynamics in crystals of rigid organic molecules: Contrasting the phonon frequencies calculated by molecular dynamics with harmonic lattice dynamics for imidazole and 5-azauracil
AE Gray, GMD †, M Leslie, SLP *
Molecular Physics
(2004)
102
Ammonium cyanate: A DFT study of crystal structure, rotational barriers and vibrational spectrum
AA *, RJC Brown, S Habershon, KDMH *, RLJ *
Molecular Physics
(2004)
102
An addressable antibody nanoarray produced on a nanostructured surface
A Bruckbauer, D Zhou, D-J Kang, YE Korchev, C Abell, D Klenerman
Journal of the American Chemical Society
(2004)
126
Rhodium Complexes of Sterically Demanding Diphosphonites:  Coordination Chemistry and Catalysis
JI van der Vlugt, R Sablong, PCMM Magusin, AM Mills, AL Spek, D Vogt
Organometallics
(2004)
23
Multi-step application of immobilized reagents and scavengers: a total synthesis of epothilone C.
RI Storer, T Takemoto, PS Jackson, DS Brown, IR Baxendale, SV Ley
Chemistry - A European Journal
(2004)
10
Prefibrillar amyloid protein aggregates share common features of cytotoxicity.
M Bucciantini, G Calloni, F Chiti, L Formigli, D Nosi, CM Dobson, M Stefani
The Journal of biological chemistry
(2004)
279
Hydrothermal synthesis and magnetic properties of novel Mn( ii ) and Zn( ii ) materials with thiolato-carboxylate donor ligand frameworks
SM Humphrey, RA Mole, JM Rawson, PT Wood
Dalton transactions (Cambridge, England : 2003)
(2004)
4
(1R,4S,5R)-3-Fluoro-1,4,5-trihydroxy-2-cyclohexene-1-carboxylic acid: the fluoro analogue of the enolate intermediate in the reaction catalyzed by type II dehydroquinases
M Frederickson, AW Roszak, JR Coggins, AJ Lapthorn, C Abell
Org Biomol Chem
(2004)
2
An Intramolecular Organocatalytic Cyclopropanation Reaction
N Bremeyer, SC Smith, SV Ley, MJ Gaunt
Angewandte Chemie International Edition
(2004)
43
Projection-reconstruction technique for speeding up multidimensional NMR spectroscopy
E Kupce, R Freeman
J Am Chem Soc
(2004)
126
Designing a metal-binding site in the scaffold of Escherichia coli KDO8PS
Z Oliynyk, L Briseño-Roa, T Janowitz, P Sondergeld, AR Fersht
Protein Engineering Design and Selection
(2004)
17
Short amino acid stretches can mediate amyloid formation in globular proteins: the Src homology 3 (SH3) case.
S Ventura, J Zurdo, S Narayanan, M Parreño, R Mangues, B Reif, F Chiti, E Giannoni, CM Dobson, FX Aviles, L Serrano
Proceedings of the National Academy of Sciences
(2004)
101
Comparison of kinetic Monte Carlo and molecular dynamics simulations of diffusion in a model glass former
TF Middleton, DJ Wales
J. Chem. Phys.
(2004)
120
A quantitative evaluation of the effects of inhibitors of tubulin assembly on polymerization induced by discodermolide, epothilone B, and paclitaxel.
DA Dabydeen, GJ Florence, I Paterson, E Hamel
Cancer chemotherapy and pharmacology
(2004)
53
Evolving cascades: The Claisen rearrangement in the development of tandem sequences of three or more reactions
BL Gray, SV Ley
Chemtracts
(2004)
17
Rapid neutral–neutral reactions at low temperatures: a new network and first results for TMC‐1
IWM Smith, E Herbst, Q Chang
Monthly Notices of the Royal Astronomical Society
(2004)
350
(1R,2R)-1,3-bis(tert-butyidimethylsilyloxy)-2-(4-hydroxybutanamido)-1-(4-nitrophenyl)-propane
D Johansson, FB Larsen, AD Bond, P Nielsen
Acta Crystallographica Section E: Crystallographic Communications
(2004)
60