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  • Currently displaying 18041 - 18060 of 29898 publications
Author(s)
Publication title
Journal Name
Publication year
Fractional charge perspective on the band gap in density-functional theory
AJ Cohen, P Mori-Sánchez, W Yang
Physical Review B
(2008)
77
Synthesis of (+)-obtusenyne
SYF Mak, NR Curtis, AN Payne, MS Congreve, AJ Wildsmith, CL Francis, JE Davies, SI Pascu, JW Burton, AB Holmes
Chemistry A European Journal
(2008)
14
Size extensivity of the direct optimized effective potential method
T Heaton-Burgess, AJ Cohen, W Yang, ER Davidson
The Journal of Chemical Physics
(2008)
128
Implicit Solvent Models and the Energy Landscape for Aggregation of the Amyloidogenic KFFE Peptide
B Strodel, DJ Wales
J Chem Theory Comput
(2008)
4
The symmetry group of nonrigid tetramethylsilane
AJ Stone
International Journal of Quantum Chemistry
(2008)
108
Synthesis and structure of the Li13 cage [{[O-P(μ-NtBu)]2Li2}3(LiCl)6Li(Cl/OnBu)0.5(thf)7], containing a [O-P(μ-NtBu)]22- dianion
WTK Chan, D Eisler, F García, S Gonzalez-Calera, M McPartlin, JV Morey, RE Mulvey, S Singh, A Steiner, DS Wright
Chemical Communications
(2008)
Urea and Guanidinium Chloride Denature Protein L in Different Ways in Molecular Dynamics Simulations
C Camilloni, AG Rocco, I Eberini, E Gianazza, RA Broglia, G Tiana
Biophys J
(2008)
94
Bayesian inference for improved single molecule fluorescence tracking.
JW Yoon, A Bruckbauer, WJ Fitzgerald, D Klenerman
Biophysical journal
(2008)
94
Hydrophobic solvation of Gay–Berne particles in modified water models
T Head-Gordon, RM Lynden-Bell
The Journal of chemical physics
(2008)
128
An electrophysiological and behavioural study of insect antifeedant properties of natural and synthetic drimane-related compounds.
WM BLANEY, MSJ SIMMONDS, SV LEY, RB KATZ
Physiological Entomology
(2008)
12
Azide monoliths as convenient flow reactors for efficient Curtius rearrangement reactions
M Baumann, IR Baxendale, SV Ley, N Nikbin, CD Smith
Organic & Biomolecular Chemistry
(2008)
6
A modular flow reactor for performing Curtius rearrangements as a continuous flow process.
M Baumann, IR Baxendale, SV Ley, N Nikbin, CD Smith, JP Tierney
Organic and Biomolecular Chemistry
(2008)
6
The degree of structural protection at the edge beta-strands determines the pathway of amyloid formation in globular proteins.
G Soldi, F Bemporad, F Chiti
J Am Chem Soc
(2008)
130
Fluorine magnetic resonance in vivo: a powerful tool in the study of drug distribution and metabolism.
DG Reid, PS Murphy
Drug Discov Today
(2008)
13
Ordered assemblies of clay nano-platelets
T Liu, B Chen, JRG Evans
Bioinspiration & biomimetics
(2008)
3
Efficient prediction of thermodynamic properties of quadrupolar fluids from simulation of a coarse-grained model: the case of carbon dioxide.
BM Mognetti, L Yelash, P Virnau, W Paul, K Binder, M Müller, LG MacDowell
Journal of Chemical Physics
(2008)
128
Dipole amplification: a principle for the self-assembly of asymmetric monomers on metal surfaces.
OPH Vaughan, A Alavi, FJ Williams, RM Lambert
Angew Chem Int Ed Engl
(2008)
47
Facile, one-step production of niacin (vitamin B3) and other nitrogen-containing pharmaceutical chemicals with a single-site heterogeneous catalyst
R Raja, JM Thomas, M Greenhill-Hooper, SV Ley, FA Almeida Paz
Chemistry A European Journal
(2008)
14
Poly[[aqua-μ3-picolinato-μ2-picolinato-dipicolinatopotassium(I)terbium(III)] 2.5-hydrate]
L Cunha-Silva, PCR Soares-Santos, HIS Nogueira, T Trindade, J Klinowski, J Rocha, FA Almeida Paz
Acta crystallographica. Section E, Structure reports online
(2008)
64
Synthesis of (+)-Obtusenyne
SYF Mak, NR Curtis, AN Payne, MS Congreve, AJ Wildsmith, CL Francis, JE Davies, SI Pascu, JW Burton, AB Holmes
Chemistry (Weinheim an der Bergstrasse, Germany)
(2008)
14