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  • Currently displaying 21041 - 21060 of 29865 publications
Author(s)
Publication title
Journal Name
Publication year
Disagreement between theory and experiment in the simplest chemical reaction: Collision energy dependent rotational distributions for H+D2→HD(ν=3,j)+D
AE Pomerantz, F Ausfelder, RN Zare, SC Althorpe, FJ Aoiz, L Banares, JF Castillo
J Chem Phys
(2004)
120
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
Collision energy dependence of the HD(ν′=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
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 ofSi(114)−(2×1)
RD Smardon, GP Srivastava, SJ Jenkins
Physical Review B
(2004)
69
Phase behavior and selectivity of DNA-linked nanoparticle assemblies
DB Lukatsky, D Frenkel
Physical review letters
(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 transactions (Cambridge, England : 2003)
(2004)
4
Numerical prediction of absolute crystallization rates in hard-sphere colloids
S Auer, D Frenkel
The Journal of chemical physics
(2004)
120
Dewetting of conducting polymer inkjet droplets on patterned surfaces.
JZ Wang, ZH Zheng, HW Li, WTS Huck, H Sirringhaus
Nature materials
(2004)
3
Binding of p53-derived ligands to MDM2 induces a variety of long range conformational changes.
O Schon, A Friedler, S Freund, AR Fersht
J Mol Biol
(2004)
336
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
Hydrophobic clustering in nonnative states of a protein: interpretation of chemical shifts in NMR spectra of denatured states of lysozyme.
PA Evans, KD Topping, DN Woolfson, CM Dobson
Proteins: Structure, Function, and Bioinformatics
(2004)
9
A molecular dynamics analysis of protein structural elements.
CB Post, CM Dobson, M Karplus
Proteins
(2004)
5
Hydrogen exchange in native and denatured states of hen egg-white lysozyme.
SE Radford, M Buck, KD Topping, CM Dobson, PA Evans
Proteins: Structure, Function, and Bioinformatics
(2004)
14
Relaxation data in NMR structure determination: Model calculations for the lysozyme–Gd3+ complex
MJ Sutcliffe, CM Dobson
Proteins: Structure, Function, and Bioinformatics
(2004)
10
A Concise Synthesis of the Octalactins
PT O'Sullivan, W Buhr, MAM Fuhry, JR Harrison, JE Davies, N Feeder, DR Marshall, JW Burton, AB Holmes
J Am Chem Soc
(2004)
126
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