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  • Currently displaying 101 - 120 of 18423 publications
Harnessing non-covalent interactions to exert control over regioselectivity and site-selectivity in catalytic reactions
HJ Davis, RJ Phipps
– Chem. Sci.
(2017)
8,
864
Modelling compound cytotoxicity using conformal prediction and PubChem HTS data
F Svensson, U Norinder, A Bender
– Toxicology Research
(2017)
6,
73
Reactions of Trimethylaluminium: Modelling the Chemical Degradation of Synthetic Lubricants.
J Slaughter, AJ Peel, AEH Wheatley
– Chemistry
(2017)
23,
167
A stress tensor eigenvector projection space for the (H2O)(5) potential energy surface
T Xu, J Farrell, R Momen, A Azizi, SR Kirk, S Jenkins, DJ Wales
– CHEMICAL PHYSICS LETTERS
(2017)
667,
25
Coordinated airborne studies in the tropics (CAST)
NRP Harris, LJ Carpenter, JD Lee, G Vaughan, MT Filus, RL Jones, B Ouyang, JA Pyle, AD Robinson, SJ Andrews, AC Lewis, J Minaeian, A Vaughan, JR Dorsey, MW Gallagher, M Le Breton, R Newton, CJ Percival, HMA Ricketts, SJB Bauguitte, GJ Nott, A Wellpott, MJ Ashfold, J Flemming, R Butler, PI Palmer, PH Kaye, C Stopford, C Chemel, H Boesch, N Humpage, A Vick, AR MacKenzie, R Hyde, P Angelov, E Meneguz, AJ Manning
– Bulletin of the American Meteorological Society
(2017)
98,
145
Polymeric electrochromic materials with donor-acceptor structures
X Lv, W Li, M Ouyang, Y Zhang, DS Wright, C Zhang
– Journal of Materials Chemistry C
(2017)
5,
12
Guest Binding and Catalysis in the Cavity of a Cubic Coordination Cage
MD Ward, CA Hunter, NH Williams
– Chemistry Letters
(2017)
46,
2
Microfluidic devices fabricated using fast wafer-scale LED-lithography patterning
PK Challa, T Kartanas, J Charmet, TPJ Knowles
– Biomicrofluidics
(2017)
11,
014113
In silico target prediction for elucidating the mode of action of herbicides including prospective validation
RK Chiddarwar, SG Rohrer, A Wolf, S Tresch, S Wollenhaupt, A Bender
– J Mol Graph Model
(2017)
71,
70
Crystal structure landscape of ethenzamide: a physicochemical property study
KK Sarmah, K Boro, M Arhangelskis, R Thakuria
– CrystEngComm
(2017)
19,
826
Aqueous interfacial gels assembled from small molecule supramolecular polymers
AS Groombridge, A Palma, RM Parker, C Abell, OA Scherman
– Chem. Sci.
(2016)
8,
1350
Chapter 17: Bio-mimetic Structural Colour using Biopolymers
R Middleton, U Steiner, S Vignolini
(2017)
2017-January,
555
Novel Adamantanyl-Based Thiadiazolyl Pyrazoles Targeting EGFR in Triple-Negative Breast Cancer
A Sebastian, V Pandey, CD Mohan, YT Chia, S Rangappa, J Mathai, CP Baburajeev, S Paricharak, LH Mervin, KC Bulusu, JE Fuchs, A Bender, S Yamada, Basappa, PE Lobie, KS Rangappa
– ACS Omega
(2016)
1,
1412
Structural Determinants of the Dictyostatin Chemotype for Tubulin Binding Affinity and Antitumor Activity Against Taxane- and Epothilone-Resistant Cancer Cells
C Trigili, I Barasoain, PA Sánchez-Murcia, K Bargsten, M Redondo-Horcajo, A Nogales, NM Gardner, A Meyer, GJ Naylor, E Gómez-Rubio, F Gago, MO Steinmetz, I Paterson, AE Prota, JF Díaz
– ACS Omega
(2016)
1,
1192
Carbon Dots as Versatile Photosensitizers for Solar-Driven Catalysis with Redox Enzymes.
GAM Hutton, B Reuillard, BCM Martindale, CA Caputo, CWJ Lockwood, JN Butt, E Reisner
– Journal of the American Chemical Society
(2016)
138,
16722
Micro- and nanoscale hierarchical structure of core-shell protein microgels
LR Volpatti, U Shimanovich, FS Ruggeri, S Bolisetty, T Mueller, TO Mason, TCT Michaels, R Mezzenga, G Dietler, TPJ Knowles
– JOURNAL OF MATERIALS CHEMISTRY B
(2016)
4,
7989
Computational tools and workflows in metabolomics: An international survey highlights the opportunity for harmonisation through Galaxy
RJM Weber, TN Lawson, RM Salek, TMD Ebbels, RC Glen, R Goodacre, JL Griffin, K Haug, A Koulman, P Moreno, M Ralser, C Steinbeck, WB Dunn, MR Viant
– Metabolomics : Official journal of the Metabolomic Society
(2016)
13,
12
Networks of Dynamic Allostery Regulate Enzyme Function
MJ Holliday, C Camilloni, GS Armstrong, M Vendruscolo, EZ Eisenmesser
– Structure (London, England : 1993)
(2017)
25,
276
Dynamics and thermodynamics of the coronene octamer described by coarse-grained potentials.
J Hernández-Rojas, F Calvo, S Niblett, DJ Wales
– Physical chemistry chemical physics : PCCP
(2017)
19,
1884
Design of a Nanoscale, CMOS-Integrable, Thermal-Guiding Structure for Boolean-Logic and Neuromorphic Computation.
D Loke, JM Skelton, T-C Chong, SR Elliott
– ACS Appl Mater Interfaces
(2016)
8,
34530

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