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  • Currently displaying 20141 - 20160 of 20178 publications
Are some packings more equal than others? A direct test of the Edwards conjecture
S Martiniani, KJ Schrenk, K Ramola, B Chakraborty, D Frenkel
– Nature Physics, 13(9), 848 (2017)
Addressing hysteresis and slow equilibration issues in cavity-based calculation of chemical potentials
D Frenkel, CR Wand, TS Totton
– Journal of Chemical Physics
Code supporting "A new processing scheme for ultra-high resolution direct infusion mass spectrometry data"
AT Zielinski, M Kalberer, C Bortolini, C Giorio, SJ Fuller, I Kourtchev, O Popoola
Impedance-based sensor for potassium ions
C Day, S Søpstad, H Ma, C Jiang, A Nathan, S Elliott, F Karet, T Hutter
– Analytica Chimica Acta
Genome-wide mapping of endogenous G-quadruplex DNA structures by chromatin immunoprecipitation and high-throughput sequencing.
R Hänsel-Hertsch, J Spiegel, G Marsico, D Tannahill, S Balasubramanian
– Nature protocols
(2018)
13,
551
Niobium Tungsten Oxides for High-rate Lithium-ion Charge Storage
KJ Griffith, K Wiaderek, G Cibin, L Marbella, C Grey
– Nature
Particulate Mass Sensing with Piezoelectric Bulk Acoustic Mode Resonators
AT Zielinski, M Kalberer, A Prasad, AA Seshia
ICE-TheOREM - End to End Semantically Aware eResearch Infrastructure for Theses
PT Sefton, OJ Downing
Unexpected stability of aqueous dispersions of raspberry-like colloids
S Vignolini, E Eiser, O Scherman
– Nature Communications
OPTIM: A program for geometry optimisation and pathway calculations
DJ Wales
A rationally designed Hsp70 variant rescues the aggregation-associated toxicity of human IAPP in cultured pancreatic islet β-cells
MN Bongiovanni, FA Aprile, P Sormanni, M Vendruscolo
– International Journal of Molecular Sciences
OPTIM: A program for optimising geometries and calculating pathways
DJ Wales
Catalysis by design: development of a bifunctional water splitting catalyst through an operando measurement directed optimization cycle
N Kornienko, N Heidary, G Cibin, E Reisner
– Chemical Science
(2018)
PATHSAMPLE: A program for generating connected stationary point databases and extracting global kinetics
DJ Wales
International chemical identifier for reactions (RInChI)
G Grethe, G Blanke, H Kraut, JM Goodman
– Journal of Cheminformatics
(2018)
10,
Chemistry Add-in to Microsoft Word
JA Townsend, P Murray-Rust, AD Wade, O Naim, S Parastatidis
Paramagnetic NMR in solution and the solid state
AJ Pell, G Pintacuda, CP Grey
– Progress in Nuclear Magnetic Resonance Spectroscopy
(2018)
HIGH-RESOLUTION C-13 MAS NMR-SPECTRA OF PARAMAGNETIC LANTHANIDE COMPLEXES
A CLAYTON, C DOBSON, C GREY
– JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS
{72-74}
Bovine Serum Albumin and Fibrinogen Adsorption at the 316L Stainless Steel/Aqueous Interface
MH Wood, CG Payagalage, T Geue
– The Journal of Physical Chemistry Part B
GMIN: A program for basin-hopping global optimisation
DJ Wales

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