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  • Currently displaying 16821 - 16840 of 29639 publications
Author(s)
Publication title
Journal Name
Publication year
Density functional molecular dynamics calculation of the dissociation constant of liquid water
M Sulpizi, M Sprik
ABSTR PAP AM CHEM S
(2009)
238
Implementation of coarse-grained models for molecular simulation on GPU architecture
I Tunbridge, RB Best, MM Kuttel
ABSTR PAP AM CHEM S
(2009)
238
Simple decoration of inclusion cavities within isostructural two-component organic salts
J Galcera, T Friščić, E Molins, W Jones
Acta Crystallographica Section A: Foundations and advances
(2009)
65
CINF 18-Reliable reactions and stable structures
JM Goodman
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
238
CATL 1-Catalyst characterization
JA Rodriguez, PJ Chupas, CP Grey
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
238
BIOT 389-Direct observation of noncooperative unfolding in human lysozyme
A Dhulesia, MF Mossuto, JR Kumita, X Salvatella, CM Dobson
ABSTR PAP AM CHEM S
(2009)
238
BIOT 177-Mechanism of formation and structural characterization of lysozyme amyloid fibrils
A Dhulesia, MF Mossuto, JR Kumita, X Salvatella, CM Dobson
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
238
Development of inhibitors for Mycobacterium tuberculosis pantothenate synthetase using a fragment-based approach
AW Hung, L Silvestre, A Ciulli, S Wen, TL Blundell, C Abell
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
238
Prediction of folding and misfolding of proteins from their amino acid sequences
M Vendruscolo
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
238
Computing the symmetry factor of redox-reactions using transition path sampling
C Drechsel-Grau, M Sprik
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
238
Density functional characterization of the acidity and redox activity of solid oxide-water interfaces
J Cheng, M Sulpizi, M Sprik
ABSTR PAP AM CHEM S
(2009)
238
Studies toward a total synthesis of the aplyronines
LYW Lee, SJ Atkinson, SJ Fink, SB Blakey, I Paterson
ABSTR PAP AM CHEM S
(2009)
238
Development of fluorination methods using continuous-flow microreactors
M Baumann, IR Baxendale, LJ Martin, SV Ley
Tetrahedron
(2009)
65
ChemInform Abstract: Hydrazine Borane: A Promising Hydrogen Storage Material.
T Huegle, MF Kuehnel, D Lentz
ChemInform
(2009)
40
On the mechanism of nonspecific inhibitors of protein aggregation: dissecting the interactions of alpha-synuclein with Congo red and lacmoid.
C Lendel, CW Bertoncini, N Cremades, CA Waudby, M Vendruscolo, CM Dobson, D Schenk, J Christodoulou, G Toth
Biochemistry
(2009)
48
A condensation-ordering mechanism in nanoparticle-catalyzed peptide aggregation.
S Auer, A Trovato, M Vendruscolo
PLoS Computational Biology
(2009)
5
The dispersion of vibrational excitations in vitreous silica
SN Taraskin, SR Elliott
Philosophical Magazine B
(2009)
77
Adaptive Evolution of p53 Thermodynamic Stability
KH Khoo, A Andreeva, AR Fersht
Journal of Molecular Biology
(2009)
393
Functionalisation of polyHIPE Materials by ATRP Surface Grafting
DM Cummins, PCMM Magusin, A Heise
(2009)
1023
Unnatural rigid scaffolds targeting the bacterial ribosome.
IA Katsoulis, C Pyrkotis, A Papakyriakou, G Kythreoti, AL Zografos, I Mavridis, VR Nahmias, P Anastasopoulou, D Vourloumis
Chembiochem
(2009)
10