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  • Currently displaying 16461 - 16480 of 29291 publications
Author(s)
Publication title
Journal Name
Publication year
Experimental and theoretical study of oxygen adsorption structures on Ag(111)
J Schnadt, J Knudsen, XL Hu, A Michaelides, RT Vang, K Reuter, Z Li, E Lægsgaard, M Scheffler, F Besenbacher
Physical Review B Condensed Matter and Materials Physics
(2009)
80
On the variational computation of a large number of vibrational energy levels and wave functions for medium-sized molecules
E Mátyus, J Simunek, AG Császár
The Journal of Chemical Physics
(2009)
131
A small molecule that disrupts G-quadruplex DNA structure and enhances gene expression.
ZAE Waller, SA Sewitz, S-TD Hsu, S Balasubramanian
Journal of the American Chemical Society
(2009)
131
A supramolecular Cu(ii) metallocyclophane probe for guanosine 5′-monophosphate
AK Nair, PP Neelakandan, D Ramaiah
Chemical Communications
(2009)
G-Quadruplex DNA Bound by a Synthetic Ligand is Highly Dynamic
PV Jena, PS Shirude, B Okumus, K Laxmi-Reddy, F Godde, I Huc, S Balasubramanian, T Ha
J Am Chem Soc
(2009)
131
PHYS 57-NMR study of electrolyte materials for solid oxide fuel cells: Yttrium doped barium zirconate
L Buannic, L Holmes, CP Grey
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
236
Density functional molecular dynamics calculation of the dissociation constant of liquid water
M Sulpizi, M Sprik
ABSTR PAP AM CHEM S
(2009)
238
Percolation in networks of nanorods
T Schilling, MA Miller, S Jungblut
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
238
Mechanosynthesis of halogen-bonded cocrystals: Mechanism, metals and materials
W Jones, T Friscic
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
ABSTR PAP AM CHEM S
(2009)
238
All-atom simulations of coupled folding-binding of unstructured proteins
RB Best
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(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
Implementation of coarse-grained models for molecular simulation on GPU architecture
I Tunbridge, RB Best, MM Kuttel
ABSTR PAP AM CHEM S
(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
BIOT 389-Direct observation of noncooperative unfolding in human lysozyme
A Dhulesia, MF Mossuto, JR Kumita, X Salvatella, CM Dobson
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
238
The kinetics and structure of protein energy landscape
MC Prentiss, DJ Wales, PG Wolynes
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
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
CINF 18-Reliable reactions and stable structures
JM Goodman
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
ABSTR PAP AM CHEM S
(2009)
238