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  • Currently displaying 20541 - 20560 of 30651 publications
Author(s)
Publication title
Journal Name
Publication year
Convergence of taboo search in continuous global optimization
M Ji, J Klinowski
Proceedings of the Royal Society A
(2006)
462
Regiospecific Ligand Oxygenation in Iron Complexes of a Carboxylate‐Containing Ligand Mediated by a Proposed FeV–Oxo Species
A Nielsen, FB Larsen, AD Bond, CJ McKenzie
Angewandte Chemie
(2006)
118
Regiospecific Ligand Oxygenation in Iron Complexes of a Carboxylate‐Containing Ligand Mediated by a Proposed FeV–Oxo Species
A Nielsen, FB Larsen, AD Bond, CJ McKenzie
Angewandte Chemie International Edition
(2006)
45
Electrodes with high power and high capacity for rechargeable lithium batteries.
K Kang, YS Meng, J Bréger, CP Grey, G Ceder
Science
(2006)
311
Structural role of (bacterio)chlorophyll ligated in the energetically unfavorable beta-position.
A Garcia-Martin, LG Kwa, B Strohmann, B Robert, AR Holzwarth, P Braun
The Journal of biological chemistry
(2006)
281
Asymmetric Conjugate Addition of Alkynylboronates to Enones: Rationale for the Intriguing Catalysis Exerted by Binaphthols
SC Pellegrinet, JM Goodman
J Am Chem Soc
(2006)
128
Macroscopic 2D Networks Self-Assembled from Nanometer-Sized Protein/DNA Complexes
M Manzanera, DJ Frankel, H Li, D Zhou, A Bruckbauer, P Kreutzmann, JM Blackburn, C Abell, T Rayment, D Klenerman, PD Barker
Nano letters
(2006)
6
The adsorption geometry of sulphur on Ir{100}: A quantitative LEED study
TJ Lerotholi, G Held, DA King
Surface Science
(2006)
600
Combination of plane wave packet and nearside-farside methods applied to the He+H+2 reaction
AN Panda, SC Althorpe
Chemical Physics Letters
(2006)
419
Deterministic and statistical methods for reconstructing multidimensional NMR spectra.
JW Yoon, SJ Godsill, E Kupce, R Freeman
Magn Reson Chem
(2006)
44
Diabatic free energy curves and coordination fluctuations for the aqueous Ag+∕Ag2+ redox couple: A biased Born-Oppenheimer molecular dynamics investigation
J Blumberger, I Tavernelli, ML Klein, M Sprik
The Journal of chemical physics
(2006)
124
Enforced Face-to-Face Stacking of Organic Semiconductor Building Blocks within Hydrogen-Bonded Molecular Cocrystals
AN Sokolov, T Friscić, LR MacGillivray
J Am Chem Soc
(2006)
128
Plenty of room at the top
D Frenkel
Nature Materials
(2006)
5
Theory of C2Hx species on Pt{110}(1 x 2): Structure, stability, and thermal chemistry
AT Anghel, SJ Jenkins, DJ Wales, DA King
Journal of Physical Chemistry B
(2006)
110
Harvesting chemical information from the internet using a distributed approach: ChemXtreme
M Karthikeyan, S Krishnan, AK Pandey, A Bender
J Chem Inf Model
(2006)
46
Thermodynamically self-consistent liquid state theories for systems with bounded potentials - art. no. 064503
BM Mladek, G Kahl, M Neumann
The Journal of chemical physics
(2006)
124
Probing the mechanism of amyloidogenesis through a tandem repeat of the PI3-SH3 domain suggests a generic model for protein aggregation and fibril formation.
R Bader, R Bamford, J Zurdo, BF Luisi, CM Dobson
Journal of molecular biology
(2006)
356
Translocation boost protein-folding efficiency of double-barreled chaperonins
I Coluzza, SM van der Vies, D Frenkel
Biophysical journal
(2006)
90
Forward Flux Sampling-type schemes for simulating rare events: Efficiency analysis
RJ Allen, D Frenkel, PRT Wolde
(2006)
Super-arrhenius diffusion in an undercooled binary Lennard-Jones liquid results from a quantifiable correlation effect
VK de Souza, DJ Wales
Physical Review Letters
(2006)
96