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Currently displaying 10721 - 10740 of 29114 publications

Sensitivity of tropical deep convection in global models: effects of horizontal resolution, surface constraints, and 3D atmospheric nudging

C Chemel, MR Russo, JS Hosking, PJ Telford, JA Pyle – Atmospheric Science Letters (2014) 16, 148

(DOI: 10.1002/asl2.540)

Sonocrystallization Yields Monoclinic Paracetamol with Significantly Improved Compaction Behavior

D-K Bučar, JA Elliott, MD Eddleston, JK Cockcroft, W Jones – Angewandte Chemie (International ed. in English) (2014) 54, 249

(DOI: 10.1002/anie.201408894)

Superposition-Enhanced Estimation of Optimal Temperature Spacings for Parallel Tempering Simulations

AJ Ballard, DJ Wales – Journal of chemical theory and computation (2014) 10, 5599

(DOI: 10.1021/ct500797a)

Determinants of G quadruplex-induced epigenetic instability in REV1-deficient cells

D Schiavone, G Guilbaud, P Murat, C Papadopoulou, P Sarkies, MN Prioleau, S Balasubramanian, JE Sale – EMBO Journal (2014) 33, 2507

(DOI: 10.15252/embj.201488398)

Local structure and structural rigidity of the green phosphor β-SiAlON:Eu2+

J Brgoch, MW Gaultois, M Balasubramanian, K Page, BC Hong, R Seshadri – Applied Physics Letters (2014) 105, 181904

(DOI: 10.1063/1.4901104)

Redox potentials and acidity constants from density functional theory based molecular dynamics.

J Cheng, X Liu, J VandeVondele, M Sulpizi, M Sprik – Acc Chem Res (2014) 47, 3522

(DOI: 10.1021/ar500268y)

Which is better at predicting quantum-tunneling rates: Quantum transition-state theory or free-energy instanton theory?

Y Zhang, T Stecher, MT Cvitaš, SC Althorpe – The Journal of Physical Chemistry Letters (2014) 5, 3976

(DOI: 10.1021/jz501889v)

HCl uptake by volcanic ash in the high temperature eruption plume: Mechanistic insights

PM Ayris, P Delmelle, C Cimarelli, EC Maters, YJ Suzuki, DB Dingwell – Geochimica et Cosmochimica Acta (2014) 144, 188

(DOI: 10.1016/j.gca.2014.08.028)

Holomorphic Hartree–Fock Theory and Configuration Interaction

HG Hiscock, AJW Thom – Journal of Chemical Theory and Computation (2014) 10, 4795

(DOI: 10.1021/ct5007696)

Modelling ligand selectivity of serine proteases using integrative proteochemometric approaches improves model performance and allows the multi-target dependent interpretation of features

QU Ain, O Méndez-Lucio, ICO Ciriano, T Malliavin, GJP van Westen, A Bender – Integrative biology : quantitative biosciences from nano to macro (2014) 6, 1023

(DOI: 10.1039/c4ib00175c)

Depth-resolved ultra-violet spectroscopic photo current-voltage measurements for the analysis of AlGaN/GaN high electron mobility transistor epilayer deposited on Si

B Ozden, C Yang, F Tong, MP Khanal, V Mirkhani, MH Sk, AC Ahyi, M Park – Applied Physics Letters (2014) 105, 172105

(DOI: 10.1063/1.4900869)

Palladium(II)-catalyzed desulfitative synthesis of aryl ketones from sodium arylsulfinates and nitriles: scope, limitations, and mechanistic studies.

B Skillinghaug, C Sköld, J Rydfjord, F Svensson, M Behrends, J Sävmarker, PJR Sjöberg, M Larhed – The Journal of organic chemistry (2014) 79, 12018

(DOI: 10.1021/jo501875n)

Synthesis of 2,3-O-benzyl-ribose and xylose and their equilibration

R Jeffrey, G Singh, PGJ Plaza-Alexander, N Singh, JM Goodman, A Bacchi, F Punzo – Tetrahedron Asymmetry (2014) 25, 1424

(DOI: 10.1016/j.tetasy.2014.09.004)

Flexible and Stretchable Lithium-Ion Batteries and Supercapacitors Based on Electrically Conducting Carbon Nanotube Fiber Springs

Y Zhang, W Bai, X Cheng, J Ren, W Weng, P Chen, X Fang, Z Zhang, H Peng – Angewandte Chemie (International ed. in English) (2014) 53, 14564

(DOI: 10.1002/anie.201409366)

Host Cofactors and Pharmacologic Ligands Share an Essential Interface in HIV-1 Capsid That Is Lost upon Disassembly

AJ Price, DA Jacques, WA McEwan, AJ Fletcher, S Essig, JW Chin, UD Halambage, C Aiken, LC James – PLoS Pathog (2014) 10, e1004459

(DOI: 10.1371/journal.ppat.1004459)

Quantitative multiplexing with nano-self-assemblies in SERS.

S Kasera, LO Herrmann, J del Barrio, JJ Baumberg, OA Scherman – Sci Rep (2014) 4, 6785

(DOI: 10.1038/srep06785)

The influence of intercalated oxygen on the properties of graphene on polycrystalline Cu under various environmental conditions

R Blume, PR Kidambi, BC Bayer, RS Weatherup, Z-J Wang, G Weinberg, M-G Willinger, M Greiner, S Hofmann, A Knop-Gericke, R Schlögl – Phys Chem Chem Phys (2014) 16, 25989

(DOI: 10.1039/c4cp04025b)