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  • Currently displaying 20541 - 20560 of 30639 publications
Author(s)
Publication title
Journal Name
Publication year
Thermodynamically self-consistent liquid state theories for systems with bounded potentials.
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
J Mol Biol
(2006)
356
Forward Flux Sampling-type schemes for simulating rare events: Efficiency analysis
RJ Allen, D Frenkel, PRT Wolde
(2006)
Translocation boost protein-folding efficiency of double-barreled chaperonins
I Coluzza, SM van der Vies, D Frenkel
Biophysical journal
(2006)
90
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
Enhancement of charge-transport characteristics in polymeric films using polymer brushes.
GL Whiting, HJ Snaith, S Khodabakhsh, JW Andreasen, DW Breiby, MM Nielsen, NC Greenham, RH Friend, WTS Huck
Nano Letters
(2006)
6
Reactive Uptake of N2O5 by Aerosol Particles Containing Mixtures of Humic Acid and Ammonium Sulfate
CL Badger, PT Griffiths, I George, JPD Abbatt, RA Cox
The journal of physical chemistry. A
(2006)
110
Sulfur, normally a poison, strongly promotes chemoselective catalytic hydrogenation: stereochemistry and reactivity of crotonaldehyde on clean and S-modified Cu(111)
ME Chiu, G Kyriakou, FJ Williams, DJ Watson, MS Tikhov, RM Lambert
Chemical Communications
(2006)
Synthesis of Li 1-αv 3O 8 via a gel precursor: Part II, from xerogel to the anhydrous material
M Dubarry, J Gaubicher, D Guyomard, N Steunou, J Livage, N Dupré, CP Grey
Chemistry of Materials
(2006)
18
Characterization of the organic composition of aerosols from Rondônia, Brazil, during the LBA-SMOCC 2002 experiment and its representation through model compounds
S Decesari, S Fuzzi, MC Facchini, M Mircea, L Emblico, F Cavalli, W Maenhaut, X Chi, G Schkolnik, A Falkovich, Y Rudich, M Claeys, V Pashynska, G Vas, I Kourtchev, R Vermeylen, A Hoffer, MO Andreae, E Tagliavini, F Moretti, P Artaxo
Atmospheric Chemistry and Physics
(2006)
6
Core domain interactions in full-length p53 in solution
DB Veprintsev, SMV Freund, A Andreeva, SE Rutledge, H Tidow, JMP Cañadillas, CM Blair, AR Fersht
Proc Natl Acad Sci U S A
(2006)
103
Solution structure of p53 core domain: Structural basis for its instability
JMP Cañadillas, H Tidow, SMV Freund, TJ Rutherford, HC Ang, AR Fersht
Proceedings of the National Academy of Sciences of the United States of America
(2006)
103
Preparation of the Neolignan Natural Product Grossamide by a Continuous-Flow Process
S Ley, I Baxendale, C Griffiths-Jones, G Tranmer
Synlett
(2006)
2006
Insertion and Assembly of Membrane Proteins via Simulation
PJ Bond, MSP Sansom
J Am Chem Soc
(2006)
128
Characterizing Bitterness: Identification of Key Structural Features and Development of a Classification Model
S Rodgers, RC Glen, A Bender
J Chem Inf Model
(2006)
46
Structural biology and bioinformatics in drug design: opportunities and challenges for target identification and lead discovery
TL Blundell, BL Sibanda, RW Montalvao, S Brewerton, V Chelliah, CL Worth, NJ Harmer, O Davies, D Burke
Philosophical Transactions of the Royal Society B: Biological Sciences
(2006)
361
Mild aerobic oxidative palladium (II) catalyzed C-H bond functionalization: Regioselective and switchable C-H alkenylation and annulation of pyrroles
EM Beck, NP Grimster, R Hatley, MJ Gaunt
J Am Chem Soc
(2006)
128
Spin Transitions in a Dithiazolyl Radical: Preparation, Crystal Structures, and Magnetic Properties of 3-Cyanobenzo-1,3,2-dithiazolyl, C7H3S2N2 •
A Alberola, RJ Collis, SM Humphrey, RJ Less, JM Rawson
Inorg Chem
(2006)
45
Diode laser spectroscopy of the ν2 fundamental band of cis-HOPO
PJ O’Sullivan, PA Hamilton, PB Davies, JM Turney, HF Schaefer
Journal of Molecular Spectroscopy
(2006)
235
Simulation of single-file ion transport with the lattice Fokker-Planck equation.
S Melchionna, S Succi, J-P Hansen
Phys Rev E Stat Nonlin Soft Matter Phys
(2006)
73