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  • Currently displaying 1 - 20 of 18939 publications
Stochastic surface walking reaction sampling for resolving heterogeneous catalytic reaction network: A revisit to the mechanism of water-gas shift reaction on Cu
XJ Zhang, C Shang, ZP Liu
– The Journal of Chemical Physics
(2017)
147,
152706
X-ray characterization of triphenylphosphine-gold(I) olefin π-complexes and the revision of their stability in solution
P Motloch, J Blahut, I Císařová, J Roithová
– Journal of Organometallic Chemistry
(2017)
848,
114
Electrochemical performance of novel O3 layered Al,Mg doped titanates as anode materials for Na-ion batteries
S Pérez-Villar, E Castillo-Martínez, JM López del Amo, T Rojo, M Armand
– Materials Research Bulletin
(2017)
94,
199
Exploiting sparsity in free energy basin-hopping
KH Sutherland-Cash, RG Mantell, DJ Wales
– Chemical Physics Letters
(2017)
685,
288
Prediction of early unplanned intensive care unit readmission in a UK tertiary-care hospital: A cross-sectional machine learning approach
T Desautels, R Das, J Calvert, M Trivedi, C Summers, DJ Wales, A Ercole
– BMJ Open
(2017)
7,
e017199
Toward a Versatile Toolbox for Cucurbit[n]uril-Based Supramolecular Hydrogel Networks through In Situ Polymerization
J Liu, C Soo Yun Tan, Y Lan, OA Scherman
– Journal of Polymer Science Part A: Polymer Chemistry
(2017)
55,
3105
Gradient-free determination of isoelectric points of proteins on chip.
U Łapińska, KL Saar, EV Yates, TW Herling, T Müller, PK Challa, CM Dobson, TPJ Knowles
– Physical chemistry chemical physics : PCCP
(2017)
19,
23060
Sequence Selective Formation of Synthetic H-Bonded Duplexes
AE Stross, G Iadevaia, D Núñez-Villanueva, CA Hunter
– Journal of the American Chemical Society
(2017)
139,
12655
Nanodroplet-Containing Polymers for Efficient Low-Power Light Upconversion.
R Vadrucci, A Monguzzi, F Saenz, BD Wilts, YC Simon, C Weder
– Adv Mater
(2017)
Tuning Product Selectivity for Aqueous CO2 Reduction with a Mn(bipyridine)-pyrene Catalyst Immobilized on a Carbon Nanotube Electrode.
B Reuillard, KH Ly, TE Rosser, MF Kuehnel, I Zebger, E Reisner
– Journal of the American Chemical Society
(2017)
Methods of probing the interactions between small molecules and disordered proteins.
GT Heller, FA Aprile, M Vendruscolo
– Cellular and Molecular Life Sciences
(2017)
74,
3225
Correction: Computationally guided discovery of a reactive, hydrophilic trans-5-oxocene dienophile for bioorthogonal labeling.
WD Lambert, SL Scinto, O Dmitrenko, SJ Boyd, R Magboo, RA Mehl, JW Chin, JM Fox, S Wallace
– Org Biomol Chem
(2017)
Optimal Alignment of Structures for Finite and Periodic Systems
M Griffiths, SP Niblett, DJ Wales
– Journal of Chemical Theory and Computation
(2017)
Nickel-Catalyzed Azide-Alkyne Cycloaddition To Access 1,5-Disubstituted 1,2,3-Triazoles in Air and Water.
WG Kim, ME Kang, JB Lee, MH Jeon, S Lee, J Lee, B Choi, PMSD Cal, S Kang, J-M Kee, GJL Bernardes, J-U Rohde, W Choe, SY Hong
– Journal of the American Chemical Society
(2017)
139,
12121
Highlights from the 52nd EUCHEM conference on stereochemistry, Bürgenstock, Switzerland, May 2017.
J Montenegro, RJ Phipps
– Chemical communications (Cambridge, England)
(2017)
53,
9960
Fast, Quantitative and Variant Enabled Mapping of Peptides to Genomes.
CN Schlaffner, GJ Pirklbauer, A Bender, JS Choudhary
– Cell Syst
(2017)
5,
152
Multiphase composition changes and reactive oxygen species formation during limonene oxidation in the new Cambridge Atmospheric Simulation Chamber (CASC)
PJ Gallimore, BM Mahon, FPH Wragg, SJ Fuller, C Giorio, I Kourtchev, M Kalberer
– Atmospheric Chemistry and Physics
(2017)
17,
9853
Polymeric Redox Active Electrodes for Sodium Ion Batteries
N Fernández, P Sanchez-Fontecoba, E Castillo-Martínez, J Carretero-González, T Rojo, M Armand
– ChemSusChem
(2017)
Signal transduction in a covalent post-assembly modification cascade
BS Pilgrim, DA Roberts, TG Lohr, TK Ronson, JR Nitschke
– Nature Chemistry
(2017)
Targeting the genome stability hub Ctf4 by stapled-peptide design
Y Wu, F Villa, J Maman, YH Lau, L Dobnikar, AC Simon, K Labib, DR Spring, L Pellegrini
– Angew Chem Int Ed Engl
(2017)

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