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  • Currently displaying 14381 - 14400 of 30393 publications
Author(s)
Publication title
Journal Name
Publication year
A state-to-state dynamical study of the Br + H2 reaction: comparison of quantum and classical trajectory results.
AN Panda, D Herráez-Aguilar, PG Jambrina, J Aldegunde, SC Althorpe, FJ Aoiz
Phys Chem Chem Phys
(2012)
14
A Highly Compliant Protein Native State with a Spontaneous-like Mechanical Unfolding Pathway
PO Heidarsson, I Valpapuram, C Camilloni, A Imparato, G Tiana, FM Poulsen, BB Kragelund, C Cecconi
J Am Chem Soc
(2012)
134
Taming the first-row diatomics: A full configuration interaction quantum Monte Carlo study
D Cleland, GH Booth, C Overy, A Alavi
Journal of chemical theory and computation
(2012)
8
Dual template synthesis of a highly mesoporous SSZ-13 zeolite with improved stability in the methanol-to-olefins reaction
L Wu, V Degirmenci, PCMM Magusin, BM Szyja, EJM Hensen
Chemical communications (Cambridge, England)
(2012)
48
Spin-transfer pathways in paramagnetic lithium transition-metal phosphates from combined broadband isotropic solid-state MAS NMR spectroscopy and DFT calculations
RJ Clément, AJ Pell, DS Middlemiss, FC Strobridge, JK Miller, MS Whittingham, L Emsley, CP Grey, G Pintacuda
Journal of the American Chemical Society
(2012)
134
Selective RNA Versus DNA G-Quadruplex Targeting by In Situ Click Chemistry
M Di Antonio, G Biffi, A Mariani, E-A Raiber, R Rodriguez, S Balasubramanian
Angewandte Chemie International Edition
(2012)
51
Salt anions promote the conversion of HypF-N into amyloid-like oligomers and modulate the structure of the oligomers and the monomeric precursor state.
S Campioni, B Mannini, JP López-Alonso, IN Shalova, A Penco, E Mulvihill, DV Laurents, A Relini, F Chiti
Journal of Molecular Biology
(2012)
424
Lithocholic acid is an endogenous inhibitor of MDM4 and MDM2.
SM Vogel, MR Bauer, AC Joerger, R Wilcken, T Brandt, DB Veprintsev, TJ Rutherford, AR Fersht, FM Boeckler
Proceedings of the National Academy of Sciences of the United States of America
(2012)
109
Improved description of soft layered materials with van der Waals density functional theory.
G Graziano, J Klimeš, F Fernandez-Alonso, A Michaelides
Journal of Physics: Condensed Matter
(2012)
24
Development of a sensitive long path absorption photometer to quantify peroxides in aerosol particles (Peroxide-LOPAP)
P Mertes, L Pfaffenberger, J Dommen, M Kalberer, U Baltensperger
Atmospheric Measurement Techniques
(2012)
5
Building on architectural principles for three-dimensional metallosupramolecular construction
MMJ Smulders, IA Riddell, C Browne, JR Nitschke
Chem. Soc. Rev.
(2012)
42
Electron transfer in dye-sensitised semiconductors modified with molecular cobalt catalysts: photoreduction of aqueous protons.
F Lakadamyali, A Reynal, M Kato, JR Durrant, E Reisner
Chemistry (Weinheim an der Bergstrasse, Germany)
(2012)
18
Sulfate-selective binding and sensing of a fluorescent [3]rotaxane host system.
MJ Langton, PD Beer
Chemistry – A European Journal
(2012)
18
Microwave-assisted Cu-catalyzed Ullmann ether synthesis in a continuous-flow milli-plant
F Benaskar, NG Patil, V Engels, EV Rebrov, J Meuldijk, LA Hulshof, V Hessel, AEH Wheatley, JC Schouten
Chemical Engineering Journal
(2012)
207-208
Absolute acidity of clay edge sites from ab-initio simulations
S Tazi, B Rotenberg, M Salanne, M Sprik, M Sulpizi
Geochimica et Cosmochimica Acta
(2012)
94
Discovery of a novel allosteric mechanism for the regulation of HCV NS3/4a protein function present across all genotypes
S Saalau-Bethell, A Woodhead, G Chessari, MG Carr, J Coyle, M Frederickson, B Graham, C Hamlett, S Hiscock, FP Holding, H Jhoti, R McMenamin, C Murray, P Pathuri, M Reader, D Rees, SJ Rich, CJ Richardson, N Thompson, ML Verdonk, M Vinkovic, PA Williams, Y Jeff
HEPATOLOGY
(2012)
56
Applications of quantum cascade lasers in plasma diagnostics: A review
J Röpcke, PB Davies, N Lang, A Rousseau, S Welzel
Journal of Physics D
(2012)
45
Modified high performance concentric nebulizer for inductively coupled plasma optical emission spectrometry
AS Groombridge, K Inagaki, SI Fujii, K Nagasawa, T Okahashi, A Takatsu, K Chiba
Journal of Analytical Atomic Spectrometry
(2012)
27
Tunability of structure from ordered to disordered and its impact on ionic conductivity behavior in the Nd2-yHoyZr2O 7 (0.0 ≤ y ≤ 2.0) system
FN Sayed, D Jain, BP Mandal, CGS Pillai, AK Tyagi
Rsc Advances
(2012)
2
Highly fluorescent benzofuran derivatives of the GFP chromophore
MA Christensen, K Jennum, PB Abrahamsen, EA Della Pia, K Lincke, SL Broman, DB Nygaard, AD Bond, MB Nielsen
RSC Advances
(2012)
2