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  • Currently displaying 18881 - 18900 of 29948 publications
Author(s)
Publication title
Journal Name
Publication year
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
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
Synthesis of new strapped porphyrins via a bisdipyrromethane condensation
J Sanders, D Gonçalves
Synlett
(2007)
2007
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
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
Proc Natl Acad Sci U S A
(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 of the United States of America
(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
The Journal of chemical physics
(2007)
126
Synthesis of CaO-P2O5-SiO2 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
Transition metal NMR chemical shifts from optimized effective potentials.
AM Teale, AJ Cohen, DJ Tozer
The Journal of Chemical Physics
(2007)
126
Structural biology - Analysis of 'downhill' protein folding
N Ferguson, TD Sharpe, CM Johnson, PJ Schartau, AR Fersht
Nature
(2007)
445
Diclofenac solubility: independent determination of the intrinsic solubility of three crystal forms.
A Llinàs, JC Burley, KJ Box, RC Glen, JM Goodman
J Med Chem
(2007)
50
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
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
Structure, mechanism and catalytic duality of thiamine-dependent enzymes.
RAW Frank, FJ Leeper, BF Luisi
Cellular and Molecular Life Sciences
(2007)
64
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 : the ACS journal of surfaces and colloids
(2007)
23
Proton and anion control of framework complexity in copper(II) complex structures derived from 2-(hydroxymethyl)pyridine
B Antonioli, DJ Bray, JK Clegg, KA Jolliffe, K Gloe, K Gloe, LF Lindoy
Polyhedron
(2007)
26
Night-time radical chemistry during the NAMBLEX campaign
R Sommariva, MJ Pilling, WJ Bloss, DE Heard, JD Lee, ZL Fleming, PS Monks, JMC Plane, A Saiz-Lopez, SM Ball, M Bitter, RL Jones, N Brough, SA Penkett, JR Hopkins, AC Lewis, KA Read
Atmospheric Chemistry and Physics
(2007)
7
Observations of the plume generated by the December 2005 oil depot explosions and prolonged fire at Buncefield (Hertfordshire, UK) and associated atmospheric changes
TA Mather, RG Harrison, VI Tsanev, DM Pyle, ML Karumudi, AJ Bennett, GM Sawyer, EJ Highwood
Proceedings of the Royal Society A
(2007)
463