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  • Currently displaying 13881 - 13900 of 29877 publications
Author(s)
Publication title
Journal Name
Publication year
Application of inhomogeneous fluid solvation theory to model the distribution and thermodynamics of water molecules around biomolecules
DJ Huggins
Physical Chemistry Chemical Physics
(2012)
14
A state-to-state dynamical study of the Br + H 2 reaction: Comparison of quantum and classical trajectory results
AN Panda, D Herráez-Aguilar, PG Jambrina, J Aldegunde, SC Althorpe, FJ Aoiz
Physical Chemistry Chemical Physics
(2012)
14
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
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
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
Angew Chem Int Ed Engl
(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 : an Institute of Physics journal
(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
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 – A European Journal
(2012)
18
Sulfate‐Selective Binding and Sensing of a Fluorescent [3]Rotaxane Host System
MJ Langton, PD Beer
Chemistry
(2012)
18
Building on architectural principles for three-dimensional metallosupramolecular construction
MMJ Smulders, IA Riddell, C Browne, JR Nitschke
Chemical Society reviews
(2012)
42
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
Applications of quantum cascade lasers in plasma diagnostics: A review
J Röpcke, PB Davies, N Lang, A Rousseau, S Welzel
Journal of Physics D Applied Physics
(2012)
45
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
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
Four-site cooperative spin crossover in a mononuclear Fe(II) complex.
A Lennartson, AD Bond, S Piligkos, CJ McKenzie
Angewandte Chemie (International ed. in English)
(2012)
51
Four‐Site Cooperative Spin Crossover in a Mononuclear FeII Complex
A Lennartson, AD Bond, S Piligkos, CJ McKenzie
Angewandte Chemie
(2012)
124