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  • Currently displaying 20481 - 20500 of 30136 publications
Author(s)
Publication title
Journal Name
Publication year
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
Frontiers in computational biophysics: A symposium in honor of Martin Karplus
CB Post, CM Dobson
Structure
(2005)
13
Tailbiter: a new amide foldamer.
CA Hunter, A Spitaleri, S Tomas
Chem Commun (Camb)
(2005)
The important role of solvent vapor in an organic solid state reaction.
S Nakamatsu, S Toyota, W Jones, F Toda
Chemical communications (Cambridge, England)
(2005)
Crystallization of the FaeE chaperone from Escherichia coli F4 fimbriae
I Van Molle, L Buts, F Coppens, L Wyns, R Loris, J Bouckaert, H De Greve
FEBS JOURNAL
(2005)
272
Conformational and dynamics study of the human papillomavirus HPV-16 E2C complexed with its DNA target sequence
T Eliseo, AD Nadra, DU Ferreiro, M Paci, G de Prat-Gay, DO Cicero
FEBS JOURNAL
(2005)
272
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
Protein misfolding and human disease: what we have learned from 50 years of protein science
CM Dobson
FEBS JOURNAL
(2005)
272
Second-sphere coordination in anion binding: sodium hexa­ammine­cobalt(III) tetra­kis­(4-fluoro­benzoate) monohydrate
RP Sharma, R Bala, R Sharma, AD Bond
Acta Crystallogr C
(2005)
61
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
Scanning Tunneling Microscopy Investigation of the Structure of Methanethiolate on Ag(111)
M Yu, SM Driver, DP Woodruff
Langmuir
(2005)
21
Novel Monte Carlo scheme for systems with short-ranged interactions.
GC Boulougouris, D Frenkel
The Journal of Chemical Physics
(2005)
122
Diastereoselective amplification of an induced-fit receptor from a dynamic combinatorial library.
PT Corbett, LH Tong, JKM Sanders, S Otto
J Am Chem Soc
(2005)
127
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
μ2-bicarbonato-κ2 O,O′)[μ2-1,4,8,11,14,18,23,27-octaaza-6,16,25(1,3)- tribenzenabicyclo[9.9.9]nona-cosaphane]dicopper(II) triperchlorate acetonitrile solvate
S Derossi, AD Bond, CJ McKenzie, J Nelson
Acta Crystallographica Section E: Crystallographic Communications
(2005)
61
Lattice-Boltzmmann simulations of the sedimentation of charged disks
F Capuani, I Pagonabarraga, D Frenkel
(2005)
State-resolved gas-surface reactivity of methane in the symmetric C-H stretch vibration on Ni(100) - art. no. 246104
P Maroni, DC Papageorgopoulos, M Sacchi, TT Dang, RD Beck, TR Rizzo
Physical Review Letters
(2005)
94