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  • Currently displaying 20501 - 20520 of 29657 publications
Author(s)
Publication title
Journal Name
Publication year
Fragment-based lead discovery using X-ray crystallography
MJ Hartshorn, CW Murray, A Cleasby, M Frederickson, IJ Tickle, H Jhoti
Journal of Medicinal Chemistry
(2004)
48
Identification of novel p38α 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
Journal of Medicinal Chemistry
(2004)
48
Effects of heme on the structure of the denatured state and folding kinetics of cytochrome b(562)
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
Quantifying the complexity of chaos in multibasin multidimensional dynamics of molecular systems
D Nerukh, G Karvounis, RC Glen
Complexity
(2004)
10
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
The 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 - art. no. 024103
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
Chemical space and biology
CM Dobson
Nature
(2004)
432
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
Environmental Science Processes & Impacts
(2004)
7
The influence of temperature and density functional models in ab initio molecular dynamics simulation of liquid water - art. no. 014515
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
Journal of Chemical Physics
(2004)
121
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
The Energy Landscape as a Unifying Theme in Molecular Science
DJ Wales
Phil. Trans. Roy. Soc. A
(2004)
363
Line strengths and transition dipole moment of the ν 2 fundamental band of the methyl radical
GD Stancu, J Röpcke, PB Davies
J Chem Phys
(2004)
122
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: Structural Chemistry
(2004)
61
The molecular physics lecture 2004: (i) Density functional theory, (ii) Quantum Monte Carlo
NC Handy
Molecular Physics
(2004)
102
Scientific biography
NC Handy
Molecular Physics
(2004)
102