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Department of Chemistry


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  • Currently displaying 61 - 80 of 20504 publications
Addressing hysteresis and slow equilibration issues in cavity-based calculation of chemical potentials.
CR Wand, TS Totton, D Frenkel
– The Journal of chemical physics
Full elucidation of the transmembrane anion transport mechanism of squaramides using in silico investigations.
I Marques, PMR Costa, M Q Miranda, N Busschaert, ENW Howe, HJ Clarke, CJE Haynes, IL Kirby, AM Rodilla, R Pérez-Tomás, PA Gale, V Félix
– Physical chemistry chemical physics : PCCP
Understanding Fluoroethylene Carbonate and Vinylene Carbonate Based Electrolytes for Si Anodes in Lithium Ion Batteries with NMR Spectroscopy.
Y Jin, N-JH Kneusels, LE Marbella, E Castillo-Martínez, PCMM Magusin, RS Weatherup, E Jónsson, T Liu, S Paul, CP Grey
– Journal of the American Chemical Society
Secondary nucleation in amyloid formation
M Törnquist, TCT Michaels, K Sanagavarapu, X Yang, G Meisl, SIA Cohen, TPJ Knowles, S Linse
– Chemical communications (Cambridge, England)
The Interactive Stratospheric Aerosol Model Intercomparison Project (ISA-MIP): Motivation and experimental design
C Timmreck, GW Mann, V Aquila, R Hommel, LA Lee, A Schmidt, C Brühl, S Carn, M Chin, SS Dhomse, T Diehl, JM English, MJ Mills, R Neely, J Sheng, M Toohey, D Weisenstein
– Geoscientific Model Development
Direct Copper-Catalyzed Three-Component Synthesis of Sulfonamides.
Y Chen, PRD Murray, AT Davies, MC Willis
– Journal of the American Chemical Society
Slow Magnetic Relaxation in a Palladium-Gadolinium Complex Induced by Electron Density Donation from the Palladium Ion
DC Izuogu, T Yoshida, H Zhang, G Cosquer, K Katoh, S Ogata, M Hasegawa, H Nojiri, M Damjanović, W Wernsdorfer, T Uruga, T Ina, BK Breedlove, M Yamashita
– Chemistry - A European Journal
Detecting RNA G-Quadruplexes (rG4s) in the Transcriptome.
CK Kwok, G Marsico, S Balasubramanian
– Cold Spring Harbor Perspectives in Biology
Stress dissipation in cucurbit[8]uril ternary complex small molecule adhesives.
P Williams, Z Walsh-Korb, S Jones, Y Lan, OA Scherman
– Langmuir
Potential impacts of emissions associated with unconventional hydrocarbon extraction on UK air quality and human health
AT Archibald, C Ordóñez, E Brent, ML Williams
– Air Quality, Atmosphere & Health
The effect of succinate on brain NADH/NAD+ redox state and high energy phosphate metabolism in acute traumatic brain injury
MG Stovell, MO Mada, A Helmy, TA Carpenter, EP Thelin, J-L Yan, MR Guilfoyle, I Jalloh, DJ Howe, P Grice, A Mason, S Giorgi-Coll, CN Gallagher, MP Murphy, DK Menon, PJ Hutchinson, KLH Carpenter
– Scientific reports
1064 nm Dispersive Raman Micro-Spectroscopy and Optical Trapping of Pharmaceutical Aerosols
PJ Gallimore, NM Davidson, M Kalberer, FD Pope, AD Ward
– Anal Chem
Gaussian approximation potential modeling of lithium intercalation in carbon nanostructures
S Fujikake, VL Deringer, TH Lee, M Krynski, SR Elliott, G Csányi
– The Journal of chemical physics
Multistep Inhibition of α-Synuclein Aggregation and Toxicity in Vitro and in Vivo by Trodusquemine.
M Perni, P Flagmeier, R Limbocker, R Cascella, FA Aprile, C Galvagnion, GT Heller, G Meisl, SW Chen, JR Kumita, PK Challa, JB Kirkegaard, SIA Cohen, B Mannini, D Barbut, EAA Nollen, C Cecchi, N Cremades, TPJ Knowles, F Chiti, M Zasloff, M Vendruscolo, CM Dobson
– ACS Chem Biol
Extending the Compositional Space of Mixed Lead Halide Perovskites by Cs, Rb, K, and Na Doping
TJ Jacobsson, S Svanström, V Andrei, JPH Rivett, N Kornienko, B Philippe, UB Cappel, H Rensmo, F Deschler, G Boschloo
– Journal of Physical Chemistry C
Kinetic barriers to α-synuclein protofilament formation and conversion into mature fibrils
JWP Brown, G Meisl, TPJ Knowles, AK Buell, CM Dobson, C Galvagnion
– Chemical communications (Cambridge, England)
Determination of Polypeptide Conformation with Nanoscale Resolution in Water
G Ramer, FS Ruggeri, A Levin, TPJ Knowles, A Centrone
– ACS Nano
Sodiation and Desodiation via Helical Phosphorus Intermediates in High-Capacity Anodes for Sodium-Ion Batteries.
LE Marbella, ML Evans, MF Groh, J Nelson, KJ Griffith, AJ Morris, CP Grey
– Journal of the American Chemical Society
From synthesis to applications: Metal– organicframeworks for an environmentally sustainable future
BM Connolly, JP Mehta, PZ Moghadam, AEH Wheatley, D Fairen-Jimenez
– Current Opinion in Green and Sustainable Chemistry
Natural ventilation in cities: the implications of fluid mechanics
J Song, S Fan, W Lin, L Mottet, H Woodward, M Davies Wykes, R Arcucci, D Xiao, JE Debay, H ApSimon, E Aristodemou, D Birch, M Carpentieri, F Fang, M Herzog, GR Hunt, RL Jones, C Pain, D Pavlidis, AG Robins, CA Short, PF Linden
– Building Research and Information