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  • Currently displaying 22201 - 22220 of 30935 publications
Author(s)
Publication title
Journal Name
Publication year
First-principles study of H2O diffusion on a metal surface: H2O on Al{100}
A Michaelides, VA Ranea, PL de Andres, DA King
Physical Review B Condensed Matter and Materials Physics
(2004)
69
5-Pyrrolidin-2-yltetrazole: A New, Catalytic, More Soluble Alternative to Proline in an Organocatalytic Asymmetric Mannich-type Reaction
AJA Cobb, DM Shaw, SV Ley
Synlett
(2004)
2004
Templated ligand assembly by using G-quadruplex DNA and dynamic covalent chemistry.
AM Whitney, S Ladame, S Balasubramanian
Angewandte Chemie International Edition
(2004)
43
Melting of Polydisperse Hard Disks
S Pronk, D Frenkel
(2004)
The Crystal Structure of Human CD1b with a Bound Bacterial Glycolipid
T Batuwangala, D Shepherd, SD Gadola, KJC Gibson, NR Zaccai, AR Fersht, GS Besra, V Cerundolo, EY Jones
Journal of Immunology
(2004)
172
Disagreement between theory and experiment in the simplest chemical reaction: Collision energy dependent rotational distributions for H+D 2→HD(v′ = 3,J′) + D
AE Pomerantz, F Ausfelder, RN Zare, SC Althorpe, FJ Aoiz, L Banares, JF Castillo
The Journal of chemical physics
(2004)
120
Collision energy dependence of the HD(nu' = 2) product rotational distribution of the H + D2 reaction in the range 1.30-1.89 eV.
F Ausfelder, AE Pomerantz, RN Zare, SC Althorpe, FJ Aoiz, L Banares, JF Castillo
The Journal of Chemical Physics
(2004)
120
Free energy and structure of dislocation cores in two-dimensional crystals
PB Bladon, D Frenkel
The Journal of Physical Chemistry B
(2004)
108
Inhibition of protein crystallization by evolutionary negative design.
JPK Doye, AA Louis, M Vendruscolo
Physical biology
(2004)
1
Electronic structure of a stepped semiconductor surface: Density functional theory of Si(114)-(2×1)
RD Smardon, GP Srivastava, SJ Jenkins
Physical Review B Condensed Matter and Materials Physics
(2004)
69
Phase Behavior and Selectivity of DNA-linked Nanoparticle Assemblies
DB Lukatsky, D Frenkel
(2004)
Phase behavior and selectivity of DNA-linked nanoparticle assemblies.
DB Lukatsky, D Frenkel
Phys Rev Lett
(2004)
92
Surface infra-red emission during alkali–metal incorporation at an oxide surface
Y-C Hou, SJ Jenkins, DA King
Surface Science
(2004)
550
Accurate determinations of the extent to which the SE2′ reactions of allyl-, allenyl- and propargylsilanes are stereospecifically anti
MJC Buckle, I Fleming, S Gil, KLC Pang
Organic & Biomolecular Chemistry
(2004)
2
Steric control in the oligomerisation of phosphazane dimers;: towards new phosphorus-nitrogen macrocycles
EL Doyle, F García, SM Humphrey, RA Kowenicki, L Riera, AD Woods, DS Wright
Dalton Trans.
(2004)
4
Numerical prediction of absolute crystallization rates in hard-sphere colloids.
S Auer, D Frenkel
The Journal of Chemical Physics
(2004)
120
Structural distortion of p53 by the mutation R249S and its rescue by a designed peptide: implications for "mutant conformation".
A Friedler, BS DeDecker, SMV Freund, C Blair, S Rüdiger, AR Fersht
J Mol Biol
(2004)
336
Binding of p53-derived ligands to MDM2 induces a variety of long range conformational changes
O Schon, A Friedler, S Freund, AR Fersht
Journal of Molecular Biology
(2004)
336
Large effect of polydispersity on defect concentrations in colloidal crystals
S Pronk, D Frenkel
(2004)
Synthesis, characterization and crystal structure of a novel europium(III) supramolecular compound: {[Eu(CH3OH)6(H2O)2] [PMo12O40]}• (C14H20O5)2•(CH3OH)2•(CH3CN)2
FL Sousa, FAA Paz, PCR Soares-Santos, AMV Cavaleiro, HIS Nogueira, J Klinowski, T Trindade
Journal of Molecular Structure
(2004)
689