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  • Currently displaying 21001 - 21020 of 30657 publications
Author(s)
Publication title
Journal Name
Publication year
Fibril formation and aggregation of a model protein can proceed from different structural conformations of the partially unfolded state
M Calamai, F Chiti, CM Dobson
FEBS JOURNAL
(2005)
272
Self-assembly of a globular protein into native-like and enzymatically active aggregates that subsequently reorganize to form amyloid structures
G Plakoutsi, F Bemporad, N Taddei, CM Dobson, F Chiti
FEBS JOURNAL
(2005)
272
Submicron patterning of Co colloid catalyst for growth of vertically aligned carbon nanotubes
VB Golokvo, HW Li, B Kleinsorge, S Hofmann, J Geng, M Cantoro, Z Yang, DA Jefferson, BFG Johnson, WTS Huck, J Robertson
Nanotechnology
(2005)
16
Nucleation in suspensions of anisotropic colloids
T Schilling, D Frenkel
Computer Physics Communications
(2005)
169
Ab initio molecular dynamics simulation of redox reactions in solution
J Blumberger, Y Tateyama, M Sprik
Computer Physics Communications
(2005)
169
Toward a Monte Carlo program for simulating vapor–liquid phase equilibria from first principles
MJ McGrath, JI Siepmann, I-FW Kuo, CJ Mundy, J VandeVondele, M Sprik, J Hutter, F Mohamed, M Krack, M Parrinello
Computer Physics Communications
(2005)
169
The symmetry and structure of crystalline surfaces
SJ Pratt, SJ Jenkins, DA King
Surface Science
(2005)
585
Mesoscopic lattice modeling of electrokinetic phenomena
I Pagonabarraga, F Capuani, D Frenkel
Computer Physics Communications
(2005)
169
Selective oxidation of benzene to phenol with nitrous oxide over MFI zeolites. 1. On the role of iron and aluminum
EJM Hensen, Q Zhu, RAJ Janssen, PCMM Magusin, PJ Kooyman, RA van Santen
Journal of Catalysis
(2005)
233
Frontiers in computational biophysics: A symposium in honor of Martin Karplus
CB Post, CM Dobson
Structure
(2005)
13
The recent turnaround in stratospheric ozone over northern middle latitudes: A dynamical modeling perspective
P Hadjinicolaou, JA Pyle, NRP Harris
Geophysical Research Letters
(2005)
32
Second-sphere coordination in anion binding: sodium hexaamminecobalt(III) tetrakis(4-fluorobenzoate) monohydrate.
RP Sharma, R Bala, R Sharma, AD Bond
Acta crystallographica. Section C, Crystal structure communications
(2005)
61
Scanning tunneling microscopy investigation of the structure of methanethiolate on Ag(111).
M Yu, SM Driver, DP Woodruff
Langmuir : the ACS journal of surfaces and colloids
(2005)
21
Diastereoselective amplification of an induced-fit receptor from a dynamic combinatorial library.
PT Corbett, LH Tong, JKM Sanders, S Otto
Journal of the American Chemical Society
(2005)
127
Novel Monte Carlo scheme for systems with short-ranged interactions
GC Boulougouris, D Frenkel
The Journal of chemical physics
(2005)
122
The crystal structure of Escherichia coli ketopantoate reductase with NADP+ bound
CMC Lobley, A Ciulli, HM Whitney, G Williams, AG Smith, C Abell, TL Blundell
Biochemistry
(2005)
44
Cooperative folding in a multi-domain protein
S Batey, LG Randles, A Steward, J Clarke
Journal of molecular biology
(2005)
349
Lattice-Boltzmmann simulations of the sedimentation of charged disks
F Capuani, I Pagonabarraga, D Frenkel
(2005)
(μ2-Bicarbonato-κ2O,O′)[μ2-1,4,8,11,14,18,23,27-octa­aza-6,16,25(1,3)-tribenzenabicyclo­[9.9.9]nona­cosa­phane]dicopper(II) triperchlorate acetonitrile solvate
S Derossi, AD Bond, CJ McKenzie, J Nelson
Acta Crystallographica Section E Structure Reports Online
(2005)
61
State-Resolved Gas-Surface Reactivity of Methane in the Symmetric C-H Stretch Vibration on Ni(100)
P Maroni, DC Papageorgopoulos, M Sacchi, TT Dang, RD Beck, TR Rizzo
Physical Review Letters
(2005)
94