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  • Currently displaying 14221 - 14240 of 30225 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
Phys Chem Chem Phys
(2012)
14
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
Physical chemistry chemical physics : PCCP
(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
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
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
Chem Commun (Camb)
(2012)
48
Selective RNA versus DNA G-quadruplex targeting by 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
(2012)
18
Sulfate‐Selective Binding and Sensing of a Fluorescent [3]Rotaxane Host System
MJ Langton, PD Beer
Chemistry (Weinheim an der Bergstrasse, Germany)
(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
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
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
Mechanism of Amination of β‑Keto Esters by Azadicarboxylates Catalyzed by an Axially Chiral Guanidine: Acyclic Keto Esters React through an E Enolate
L Simón, JM Goodman
Journal of the American Chemical Society
(2012)
134
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