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  • Currently displaying 21421 - 21440 of 30663 publications
Author(s)
Publication title
Journal Name
Publication year
Identification of novel p38alpha MAP kinase inhibitors using fragment-based lead generation.
AL Gill, M Frederickson, A Cleasby, SJ Woodhead, MG Carr, AJ Woodhead, MT Walker, MS Congreve, LA Devine, D Tisi, M O'Reilly, LCA Seavers, DJ Davis, J Curry, R Anthony, A Padova, CW Murray, RAE Carr, H Jhoti
J Med Chem
(2004)
48
Fragment-based lead discovery using X-ray crystallography
MJ Hartshorn, CW Murray, A Cleasby, M Frederickson, IJ Tickle, H Jhoti
J Med Chem
(2004)
48
Quantifying the complexity of chaos in multibasin multidimensional dynamics of molecular systems
D Nerukh, G Karvounis, RC Glen
Complexity
(2004)
10
Effects of heme on the structure of the denatured state and folding kinetics of cytochrome b562
P Garcia, M Bruix, M Rico, S Ciofi-Baffoni, L Banci, MC Ramachandra Shastry, H Roder, T de Lumley Woodyear, CM Johnson, AR Fersht, PD Barker
J Mol Biol
(2004)
346
Biophysical investigations of engineered polyproteins: implications for force data.
RWS Rounsevell, A Steward, J Clarke
Biophysical Journal
(2004)
88
Yttrium Aluminum Garnet (YAG) Films through a Precursor Plasma Spraying Technique
SD Parukuttyamma, J Margolis, H Liu, CP Grey, S Sampath, H Herman, JB Parise
Journal of the American Ceramic Society
(2004)
84
Binding of Rad51 and other peptide sequences to a promiscuous, highly electrostatic binding site in p53.
A Friedler, DB Veprintsev, T Rutherford, KI von Glos, AR Fersht
Journal of Biological Chemistry
(2004)
280
Dipotassium hexakis({2,2′-[ethane-1,2-diyl-bis(nitrilomethylidyne)]diphenolato} nickel(II)) tetracyanonickelate(II) methanol hexasolvate dihydrate
S Skovsgaard, AD Bond, CJ McKenzie
Acta Crystallographica Section E Structure Reports Online
(2004)
61
Archetypal energy landscapes: Dynamical diagnosis
F Despa, DJ Wales, RS Berry
The Journal of chemical physics
(2004)
122
Investigating the Effects of Mutations on Protein Aggregation in the Cell
G Calloni, S Zoffoli, M Stefani, CM Dobson, F Chiti
Journal of Biological Chemistry
(2004)
280
The influence of temperature and density functional models in ab initio molecular dynamics simulation of liquid water
J VandeVondele, F Mohamed, M Krack, J Hutter, M Sprik, M Parrinello
Journal of Chemical Physics
(2004)
122
Density functional calculation of the electronic absorption spectrum of Cu+ and Ag+ aqua ions
L Bernasconi, J Blumberger, M Sprik, R Vuilleumier
J Chem Phys
(2004)
121
A low cost instrument based on a solid state sensor for balloon-borne atmospheric O3 profile sounding
GM Hansford, RA Freshwater, RA Bosch, RA Cox, RL Jones, KFE Pratt, DE Williams
Journal of Environmental Monitoring
(2004)
7
Chemical space and biology
CM Dobson
Nature
(2004)
432
Synthesis and structure determination of a new organically templated scandium fluorophosphate framework and its indium analogue
H Park, I Bull, L Peng, VG Young, CP Grey, JB Parise
Chemistry of Materials
(2004)
16
Line strengths and transition dipole moment of the ν 2 fundamental band of the methyl radical
GD Stancu, J Röpcke, PB Davies
The Journal of Chemical Physics
(2004)
122
The Energy Landscape as a Unifying Theme in Molecular Science
DJ Wales
Philosophical transactions. Series A, Mathematical, physical, and engineering sciences
(2004)
363
Resolution of (S,S)-4-(2,2,4-trimethylchroman-4-yl)phenyl camphanate and its 4-chromanyl epimer by crystallization
C Esterhuysen, MW Bredenkamp, GO Lloyd
Acta crystallographica. Section C, Crystal structure communications
(2004)
61
Speed-up of Monte Carlo simulations by sampling of rejected states
D Frenkel
Proceedings of the National Academy of Sciences of the United States of America
(2004)
101
Scientific biography - Nicholas Charles Handy
NC Handy
Molecular Physics
(2004)
102