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  • Currently displaying 20161 - 20180 of 31135 publications
Author(s)
Publication title
Journal Name
Publication year
Application of Fragment Screening by X-ray Crystallography to the Discovery of Aminopyridines as Inhibitors of β-Secretase
M Congreve, D Aharony, J Albert, O Callaghan, J Campbell, RAE Carr, G Chessari, S Cowan, PD Edwards, M Frederickson, R McMenamin, CW Murray, S Patel, N Wallis
J Med Chem
(2007)
50
Bioclipse: an open source workbench for chemo- and bioinformatics
O Spjuth, T Helmus, EL Willighagen, S Kuhn, M Eklund, J Wagener, P Murray-Rust, C Steinbeck, JES Wikberg
BMC Bioinformatics
(2007)
8
Functional tetrametallic linker modules for coordination polymers and metal-organic frameworks.
FB Johansson, AD Bond, CJ McKenzie
Inorganic chemistry
(2007)
46
Application of fragment screening by X-ray crystallography to beta-secretase.
CW Murray, O Callaghan, G Chessari, A Cleasby, M Congreve, M Frederickson, MJ Hartshorn, R McMenamin, S Patel, N Wallis
Journal of Medicinal Chemistry
(2007)
50
Ab initio molecular dynamics study of ascorbic acid in aqueous solution
F Costanzo, M Sulpizi, J Vandevondele, RGD Valle, M Sprik
Molecular Physics
(2007)
105
Synthesis of New Strapped Porphyrins via a Bisdipyrromethane Condensation
J Sanders, D Gonçalves
Synlett
(2007)
2007
Simple off-lattice model to study the folding and aggregation of peptides
N Combe, D Frenkel
Molecular Physics
(2007)
105
Bilayer deformation by the Kv channel voltage sensor domain revealed by self-assembly simulations
PJ Bond, MSP Sansom
Proceedings of the National Academy of Sciences of the United States of America
(2007)
104
Conformational entropy of alanine versus glycine in protein denatured states
KA Scott, DOV Alonso, S Sato, AR Fersht, V Daggett
Proceedings of the National Academy of Sciences
(2007)
104
Reaction Site Mapping of Xenobiotic Biotransformations
S Boyer, CH Arnby, L Carlsson, J Smith, V Stein, RC Glen
Journal of Chemical Information and Modeling
(2007)
47
Energy landscape view of nonideality in binary mixtures.
SE Abraham, D Chakrabarti, B Bagchi
J Chem Phys
(2007)
126
Transition metal NMR chemical shifts from optimized effective potentials.
AM Teale, AJ Cohen, DJ Tozer
The Journal of chemical physics
(2007)
126
Synthesis of CaO-P<sub>2</sub>O<sub>5</sub>-SiO<sub>2</sub> Monolithic with Double Pore Structure by Peg /Starch
HB Yang, Q Chen, L Song, HP Li, JY Lu, WZ Zhang
Key Engineering Materials
(2007)
330-332 II
Diclofenac solubility:: Independent determination of the intrinsic solubility of three crystal forms
A Llinàs, JC Burley, KJ Box, RC Glen, JM Goodman
Journal of Medicinal Chemistry
(2007)
50
Analysis of 'downhill' protein folding
N Ferguson, TD Sharpe, CM Johnson, PJ Schartau, AR Fersht
Nature
(2007)
445
The asymmetric synthesis of β-lactams:: HETPHOX/Cu(I) mediated synthesis via the Kinugasa reaction
AG Coyne, H Müller-Bunz, PJ Guiry
Tetrahedron: Asymmetry
(2007)
18
Atom–atom potentials from ab initio calculations
AJ Stone, AJ Misquitta
International Reviews in Physical Chemistry
(2007)
26
Structure, mechanism and catalytic duality of thiamine-dependent enzymes
RAW Frank, FJ Leeper, BF Luisi
Cell Mol Life Sci
(2007)
64
Polarization relaxation in an ionic liquid confined between electrified walls.
C Pinilla, MG Del Pópolo, J Kohanoff, RM Lynden-Bell
Journal of Physical Chemistry B
(2007)
111
Synthesis and characterization of poly(3-sulfopropylmethacrylate) brushes for potential antibacterial applications.
M Ramstedt, N Cheng, O Azzaroni, D Mossialos, HJ Mathieu, WTS Huck
Langmuir
(2007)
23