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  • Currently displaying 17121 - 17140 of 29898 publications
Author(s)
Publication title
Journal Name
Publication year
PHYS 197-Are current molecular dynamics force fields too helical?
RB Best, G Hummer
ABSTR PAP AM CHEM S
(2009)
237
Studying the reaction of T-Al (T = Co, Ni, Cu, Zn) mixed metal oxides, derived from layered double hydroxide precursors, in aqueous molybdate containing solution
SJ Mitchell, A Gomez Aviles, C Gardner, W Jones
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
237
Ions at aqueous interfaces: From water surface to hydrated proteins
J Heyda, R Vacha, J Vondrasek, P Jungwirth
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
237
Development and characterization of cyclic analogs of apelin-13 through replica-exchange molecular dynamics and experimental validation
NJM Macaluso, SL Pitkin, PN Sanderson, AP Davenport, RC Glen
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY
(2009)
237
Novel retrieval of volcanic SO2 abundance from ultraviolet spectra
GG Salerno, MR Burton, C Oppenheimer, T Caltabiano, VI Tsanev, N Bruno
Journal of Volcanology and Geothermal Research
(2009)
181
Evaluation of the new UKCA climate-composition model - Part 1: The stratosphere
O Morgenstern, P Braesicke, FM O'Connor, AC Bushell, CE Johnson, SM Osprey, JA Pyle
Geoscientific Model Development
(2009)
2
A Meta-Selective Copper-Catalyzed C-H Bond Arylation
RJ Phipps, MJ Gaunt
Science
(2009)
323
Characterization of Oligomeric Species on the Aggregation Pathway of Human Lysozyme
E Frare, MF Mossuto, PP de Laureto, S Tolin, L Menzer, M Dumoulin, CM Dobson, A Fontana
J Mol Biol
(2009)
387
Effect of initial estimates and constraints selection in multivariate curve resolution—Alternating least squares. Application to low-resolution NMR data
G Vivó-Truyols, M Ziari, PCMM Magusin, PJ Schoenmakers
Analytica chimica acta
(2009)
641
Characterization of atmospheric aerosols at a forested site in central Europe
I Kourtchev, L Copolovici, M Claeys, W Maenhaut
Environmental Science and Technology
(2009)
43
Quantum Wave Packet Method for State-to-State Reactive Scattering Calculations on AB plus CD -> ABC plus D Reactions
MT Cvitas, SC Althorpe
J Phys Chem A
(2009)
113
Simultaneous measurement of reactions in microdroplets filled by concentration gradients.
N Damean, LF Olguin, F Hollfelder, C Abell, WTS Huck
Lab on a chip
(2009)
9
Second-Order Perturbation Theory with Fractional Charges and Fractional Spins
AJ Cohen, P Mori-Sánchez, W Yang
J Chem Theory Comput
(2009)
5
Dynamical arrest in low density dipolar colloidal gels.
MA Miller, R Blaak, CN Lumb, J-P Hansen
J Chem Phys
(2009)
130
Molecular dynamics study of the melting of a supported 887-atom Pd decahedron
D Schebarchov, SC Hendy, W Polak
Journal of Physics: Condensed Matter
(2009)
21
A polarised ATR study of structural orientation in dry and humid thin HPMC films
ME Pedley, PB Davies
Vibrational Spectroscopy
(2009)
49
Modulation of the oligomerization state of p53 by differential binding of proteins of the S100 family to p53 monomers and tetramers.
J van Dieck, MR Fernandez-Fernandez, DB Veprintsev, AR Fersht
The Journal of biological chemistry
(2009)
284
Refined kinetic transition networks for the GB1 hairpin peptide.
JM Carr, DJ Wales
Phys Chem Chem Phys
(2009)
11
Evaluation of coupled perturbed and density functional methods of computing the parity-violating energy difference between enantiomers.
AJ MacDermott, GO Hyde, AJ Cohen
Origins of Life and Evolution of Biospheres
(2009)
39
Effects of Alkali Cations and Halide Anions on the DOPC Lipid Membrane
R Vácha, SWI Siu, M Petrov, RA Böckmann, J Barucha-Kraszewska, P Jurkiewicz, M Hof, ML Berkowitz, P Jungwirth
The journal of physical chemistry. A
(2009)
113