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  • Currently displaying 19141 - 19160 of 29869 publications
Author(s)
Publication title
Journal Name
Publication year
Using DL_POLY to study the sensitivity of liquid structure to potential parameters
RM Lynden-Bell, TGA Youngs
Molecular Simulation
(2006)
32
Monte Carlo Study of Substrate-Induced Folding and Refolding of Lattice Proteins
I Coluzza, D Frenkel
Biophysical Journal
(2006)
92
Molecular dynamics in a grid computing environment:: experiences using DL_POLY_3 within the eMinerals escience project
MT Dove, LA Sullivan, AM Walker, RP Bruin, TOH White, K Trachenko, P Murray-Rust, IT Todorov, RP Tyer, PA Couch, KK van Dam, W Smith
Molecular Simulation
(2006)
32
Defect states in amorphous silicon
SR Elliott
Philosophical Magazine B
(2006)
38
Photo-induced changes in glow-discharge-deposited amorphous silicon: The Staebler-Wronski effect
SR Elliott
Philosophical Magazine B
(2006)
39
Individually adaptable automatic QT detector
YC Chesnokov, D Nerukh, RC Glen
Computers in Cardiology
(2006)
33
Computer simulations of long-time tails: What's new?
MA van der Hoef, D Frenkel
Transport Theory and Statistical Physics
(2006)
24
A one-pot synthesis of hybrid organo-layered double hydroxide catalyst precursors
HC Greenwell, W Jones, DN Stamires, P O'Connor, MF Brady
Green Chemistry
(2006)
8
An Effective Two-Component Description of Colloid−Polymer Phase Separation
A Pelissetto, J-P Hansen
Macromolecules
(2006)
39
Aqua[bis(2-pyridylmethyl)amine][chelidonato(1.5–)]copper(II) chelidonate(0.5–) monohydrate
M Fainerman-Melnikova, JK Clegg, R Codd
Acta Crystallographica Section E Structure Reports Online
(2006)
62
N-terminal truncation enables crystallization of the receptor-binding domain of the FedF bacterial adhesin
M De Kerpel, I Van Molle, L Brys, L Wyns, H De Greve, J Bouckaert
Acta crystallographica. Section F, Structural biology and crystallization communications
(2006)
62
Automatic quantification of changes in bone in serial MR images of joints
KK Leung, M Holden, N Saeed, KJ Brooks, JB Buckton, AA Williams, SP Campbell, K Changani, DG Reid, Y Zhao, M Wilde, D Rueckert, JV Hajnal, DLG Hill
IEEE transactions on medical imaging
(2006)
25
Enantioselective organocatalysis
MJ Gaunt, CCC Johansson, A McNally, NT Vo
Drug Discov Today
(2006)
12
Normal and Aberrant Biological Self‐Assembly: Insights from Studies of Human Lysozyme and Its Amyloidogenic Variants
M Dumoulin, JR Kumita, CM Dobson
ChemInform
(2006)
37
Apparent cooperativity in the folding of multidomain proteins depends on the relative rates of folding of the constituent domains
S Batey, J Clarke
Proc Natl Acad Sci U S A
(2006)
103
Many-electron self-interaction error in approximate density functionals
P Mori-Sánchez, AJ Cohen, W Yang
The Journal of chemical physics
(2006)
125
Chemical double-mutant cycles: Dissecting non-covalent interactions
SL Cockroft, CA Hunter
Chem. Soc. Rev.
(2006)
36
Development of a novel site-specific mutagenesis assay using MALDI-ToF MS (SSMA-MS)
KIE McLuckie, JH Lamb, JK Sandhu, HL Pearson, K Brown, PB Farmer, DJL Jones
Nucleic Acids Res
(2006)
34
Intercalating nucleic acids (INAs) containing insertions of 6H-indolo[2,3-b]quinoxaline
MC Wamberg, AA Hassan, AD Bond, EB Pedersen
Tetrahedron
(2006)
62
Neutron scattering and thermodynamic investigations of thin films of n-alkanes adsorbed on MgO(100) surfaces
T Arnold, RE Cook, S Chanaa, SM Clarke, M Farinelli, P Yaron, JZ Larese
Physica B Condensed Matter
(2006)
385