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Number of items: 461.

A

Abis, Laura, Freakley, Simon J., Dodekatos, Georgios, Morgan, David, Sankar, Meenakshisundaram, Dimitratos, Nikolaos, He, Qian, Kiely, Christopher and Hutchings, Graham 2017. Highly active gold and gold-palladium catalysts prepared by colloidal methods in the absence of polymer stabilizers. ChemCatChem 9 (15) , pp. 2914-2918. 10.1002/cctc.201700483
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Adedigba, Abdul-Lateef, Sankar, Gopinathan, Catlow, Charles Richard, Du, Yonghua, Xi, Shibo and Borgna, Armando 2017. On the synthesis and performance of hierarchical nanoporous TS-1 catalysts. Microporous and Mesoporous Materials 244 , pp. 83-92. 10.1016/j.micromeso.2017.02.048
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Adjimi, S., García-Vargas, J.M., Díaz, J.A., Retailleau, L., Gil, S., Pera-Titus, M., Guo, Y. and Giroir-Fendler, A. 2017. Highly efficient and stable Ru/K-OMS-2 catalyst for NO oxidation. Applied Catalysis B: Environmental 219 , pp. 459-466. 10.1016/j.apcatb.2017.07.044

Agarwal, Nishtha, Freakley, Simon J., McVicker, Rebecca U., Althahban, Sultan M., Dimitratos, Nikolaos, He, Qian, Morgan, David J., Jenkins, Robert L., Willock, David J., Taylor, Stuart H., Kiely, Christopher J. and Hutchings, Graham J. 2017. Aqueous Au-Pd colloids catalyze selective CH4 oxidation to CH3OH with O2 under mild conditions. Science 358 (6360) , pp. 223-227. 10.1126/science.aan6515
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Ahmed, Tarek, Nash, Anthony, Clark, Kristina, Ghibaudo, Marion, De Leeuw, Nora, Potter, Anne, Stratton, Richard, Birch, Helen, Enea Casse, Ramona and Bozec, Laurent 2017. Combining nano-physical and computational investigations to understand the nature of “aging” in dermal collagen. International Journal of Nanomedicine 2017 (12) , pp. 3303-3314. 10.2147/IJN.S121400
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Al-Azzawi, Ammar 2017. The interactions of optoelectronically active molecules and complexes with (bio) macromolecules for applications in biosensors and directed assembly. PhD Thesis, Cardiff University.
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Al-Nayili, Abbas 2017. Novel Lewis acidic zeolites as heterogeneous catalysts for liquid phase chemistry. PhD Thesis, Cardiff University.
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Al-Rifai, Noor, Miedziak, Peter John, Morad, Moataz, Meenakshisundaram, Sankar, Waldron, Conor, Cattaneo, Stefano, Cao, Enhong, Pattisson, Samuel, Morgan, David, Bethell, Donald, Hutchings, Graham John and Gavriilidis, Asterios 2017. Deactivation behaviour of supported gold palladium nanoalloy catalysts during the selective oxidation of benzyl alcohol in a micro-packed bed reactor. Industrial & Engineering Chemistry Research 56 (45) , pp. 12984-12993. 10.1021/acs.iecr.7b01159
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Alaboosh, Jamal 2017. Synthesis of nucleic acid-binding ligands. PhD Thesis, Cardiff University.
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Albilali, Reem and Dimitratos, Nikolaos 2017. Transfer dehydrogenation of 1-Phenylethanol over Pd/C under mild conditions: effect of reaction conditions and optimization of catalytic performance. Catalysis Letters 147 (9) , pp. 2372-2384. 10.1007/s10562-017-2140-3
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Albilali, Reem K., Douthwaite, John Mark, He, Qian and Taylor, Stuart H. 2017. The selective hydrogenation of furfural over supported palladium nanoparticle catalysts prepared by sol-immobilisation: effect of catalyst support and reaction conditions. Catalysis Science and Technology 2018 (8) , pp. 252-267. 10.1039/C7CY02110K
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Aldmairi, Abdu H., Griffiths-Jones, Charlotte, Dupauw, Alexis, Henderson, Laura and Knight, David 2017. Piperidines from acid-catalysed cyclisations: Pitfalls, solutions and a new ring contraction to pyrrolidines. Tetrahedron Letters 58 (38) , pp. 3690-3694. 10.1016/j.tetlet.2017.07.058
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Aldmairi, Abdul Hadi, Knight, David and Wirth, Thomas 2017. Acid-catalyzed tandem process for the one-pot synthesis of oxazolidines. Synlett 28 (20) , pp. 2976-2978. 10.1055/s-0036-1591513
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Alsaiari, Raiedhah 2017. Effects of reaction conditions on the conversion of epoxides to cyclic carbonates through CO2 inclusion. PhD Thesis, Cardiff University.
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Alsaiari, Raiedhah, Perrott, Luke T., Nowicka, Ewa, Engel, Rebecca V., Miedziak, Peter J., Kondrat, Simon A., Edwards, Jennifer K., Willock, David James and Hutchings, Graham John 2017. The effect of ring size on the selective carboxylation of cycloalkene oxides. Catalysis Science & Technology 2017 (6) , pp. 1433-1439. 10.1039/C6CY02448C
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Alshammari, Mohammed B., Smith, Keith, Hegazy, Amany S., Kariuki, Benson and El-Hiti, Gamal A. 2017. Crystal structure of 3-(2-(4-chlorophenyl)-3-hydroxy-3,3-diphenylpropyl)-1,1-dimethylurea, C24H25ClN2O2. Zeitschrift für Kristallographie - New Crystal Structures 232 (1) , pp. 101-104. 10.1515/ncrs-2016-0170
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Amoroso, Angelo James, Fallis, Ian Andrew and Pope, Simon J. A. 2017. Chelating agents for radiolanthanides: applications to imaging and therapy. Coordination Chemistry Reviews 340 , pp. 198-219. 10.1016/j.ccr.2017.01.010
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Angelastro, Antonio 2017. Chemoenzymatic synthesis of isotopically labelled folates. PhD Thesis, Cardiff University.
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Angelastro, Antonio, Dawson, William M., Luk, Louis Y. P. and Allemann, Rudolf K. 2017. A versatile disulfide-driven recycling system for NADP+ with high cofactor turnover number. ACS Catalysis 7 (2) , pp. 1025-1029. 10.1021/acscatal.6b03061
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Angelastro, Antonio, Dawson, William M., Luk, Louis Y. P., Loveridge, E. Joel and Allemann, Rudolf K. 2017. Chemoenzymatic assembly of isotopically labeled folates. Journal of the American Chemical Society 139 (37) , pp. 13047-13054. 10.1021/jacs.7b06358
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Antonangelo, A. R., Westrup, K. C. M., Burt, L. A., Bezzu, C. Grazia, Malewschik, T., Machado, G. S., Nunes, F. S., McKeown, N. B. and Nakagaki, S. 2017. Synthesis, crystallographic characterization and homogeneous catalytic activity of novel unsymmetric porphyrins. RSC Advances 7 (80) , pp. 50610-50618. 10.1039/C7RA08734A
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Antonangelo, Ariana R., Bezzu, Grazia, Mughal, Sabeeha S., Malewschik, Talita, McKeown, Neil B. and Nakagaki, Shirley 2017. A porphyrin-based microporous network polymer that acts as an efficient catalyst for cyclooctene and cyclohexane oxidation under mild conditions. Catalysis Communications 99 , p. 100. 10.1016/j.catcom.2017.05.024
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Aparicio-Anglès, Xavier and De Leeuw, Nora H. 2017. Modeling of complex interfaces: Gadolinium-doped ceria in contact with yttria-stabilized zirconia. Journal of the American Ceramic Society 100 (7) , pp. 3329-3339. 10.1111/jace.14858
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Aradottir, G.I., Martin, J.L., Clark, S.J., Pickett, John and Smart, L.E. 2017. Searching for wheat resistance to aphids and wheat bulb fly in the historical Watkins and Gediflux wheat collections. Annals of Applied Biology 170 (2) , pp. 179-188. 10.1111/aab.12326
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Armstrong, Robert, Kariuki, Benson, Knight, David and Hutchings, Graham John 2017. How to synthesise high purity, crystalline D-glucaric acid selectively. European Journal of Organic Chemistry 2017 (45) , pp. 6811-6814. 10.1002/ejoc.201701343
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Arora, Mallika, Pineda, Sergio, Williams, Philip, Harris, Kenneth and Kariuki, Benson 2017. Polymorphic adaptation. Presented at: 17th International Conference, CAAD Futures 2017, Istanbul, 12-14 July 2017. Published in: Çağdaş, Gülen, Özkar, Mine, Gül, Leman F. and Gürer, Ethem eds. Future Trajectories of Computation in Design. Istanbul: Istanbul Technical University, pp. 474-491.

Arvanitidis, Athanasios G., Vandaele, Eva R. J., Szopa, Marek and Ceulemans, Arnout 2017. The quantization of theE ⊗ e Jahn–Teller Hamiltonian. Journal of Physical Chemistry A 121 (38) , pp. 7246-7524. 10.1021/acs.jpca.7b06136

Athar, Mohd, Lone, Mohsin Y., Khedkar, Vijay M., Radadiya, Ashish, Shah, Anamik and Jha, Prakash C. 2017. Structural investigation of Vinca Domain Tubulin Binders by pharmacophore, atom based QSAR, docking and molecular dynamics simulations. Combinatorial Chemistry and High Throughput Screening 20 (8) , pp. 682-695. 10.2174/1386207320666170509151253
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Attard, Gary Anthony, Hunter, Katherine, Wright, Edward, Sharman, Jonathan, Martínez-Hincapié, Ricardo and Feliu, Juan M. 2017. The voltammetry of surfaces vicinal to Pt{110}: structural complexity simplified by CO cooling. Journal of Electroanalytical Chemistry 793 , pp. 137-146. 10.1016/j.jelechem.2016.10.005
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Ayres, James, Ashford, Matthew, Stockl, Yannick, Prudhomme, Vassili, Ling, Kenneth B., Platts, James and Morrill, Louis 2017. Deoxycyanamidation of alcohols with N-Cyano-N-phenyl-p-methylbenzenesulfonamide (NCTS). Organic Letters 19 (14) , pp. 3835-3838. 10.1021/acs.orglett.7b01710
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B

Bahili, Mohammed 2017. Synthesis of polyesters by ring opening polymerization and copolymerization using aluminium and titanium complexes. PhD Thesis, Cardiff University.
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Bahruji, H., Bowker, M., Jones, W., Hayward, J., Ruiz Esquius, J., Morgan, D. J. and Hutchings, G. J. 2017. PdZn catalysts for CO2 hydrogenation to methanol using chemical vapour impregnation (CVI). Faraday Discussions 197 , pp. 309-324. 10.1039/C6FD00189K
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Bahruji, Hasliza, Guan, Shaoliang and Puthiyapura, Vinod Kumar 2017. Precious metal catalysts for sustainable energy and environmental remediation. In: Hutchings, Graham, Davidson, Matthew, Catlow, Ricahrd, Hardacre, Christopher, Turner, Nicholas and Collier, Paul eds. Modern Developments in Catalysis, World Scientific Publishing, pp. 211-251. (10.1142/9781786341228_0007)

Balakit, A. A., Sert, Y., Çırak, Ç., Smith, Keith, Kariuki, Benson and El-Hiti, G. A. 2017. Synthesis, vibrational spectra, and DFT simulations of 3-bromo-2-methyl-5-(4-nitrophenyl)thiophene. Journal of Applied Spectroscopy 84 (5) , pp. 888-899. 10.1007/s10812-017-0561-9
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Belz, Tyson, Jin, Yi, Coines, Joan, Rovira, Carme, Davies, Gideon J. and Williams, Spencer J. 2017. An atypical interaction explains the high-affinity of a non-hydrolyzable S-linked 1,6-α-mannanase inhibitor. Chemical Communications 53 , pp. 9238-9241. 10.1039/C7CC04977C
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Bhatt, Jayesh S., Chutia, Arunabhiram, Catlow, Charles Richard A. and Coppens, Marc-Olivier 2017. Quantum and statistical mechanical simulations for porous catalyst modelling. In: Hutchings, Graham John, Davidson, Matthew, Catlow, Charles Richard A., Hardacre, Christopher, Turner, Nicholas and Collier, Paul eds. Modern Developments in Catalysis, World Scientific Publishing, pp. 253-288. (10.1142/9781786341228_0008)

Biggs, Caroline I., Packer, Christopher, Hindmarsh, Steven, Walker, Marc, Wilson, Neil R., Rourke, Jonathan P. and Gibson, Matthew I. 2017. Impact of sequential surface-modification of graphene oxide on ice nucleation. Physical Chemistry Chemical Physics 19 (33) , pp. 21929-21932. 10.1039/C7CP03219F
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Biswas, Saptarshi, Ma, Shuwen, Nuzzo, Stefano, Twamley, Brendan, Russell, Andrew T., Platts, James A., Hartl, František and Baker, Robert J. 2017. Structural variability of 4f and 5f thiocyanate complexes and dissociation of uranium(III)‒ thiocyanate bonds with increased ionicity. Inorganic Chemistry 56 (23) , pp. 14426-14437. 10.1021/acs.inorgchem.7b01560
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Black, Joshua 2017. Development and applications of Quasi-Variational Coupled-Cluster theory. PhD Thesis, Cardiff University.
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Blackaby, William J. M., Sabater, Sara, Poulten, Rebecca C., Page, Michael J., Folli, Andrea, Krewald, Vera, Mahon, Mary F., Murphy, Damien M., Richards, Emma and Whittlesey, Michael K. 2017. Mono- and dinuclear Ni(i) products formed upon bromide abstraction from the Ni(i) ring-expanded NHC complex [Ni(6-Mes)(PPh3)Br]. Dalton Transactions 47 (3) , pp. 769-782. 10.1039/C7DT04187J
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Blackburn, G. Michael, Cherfils, Jacqueline, Moss, Gerard P., Richards, Nigel G. J., Waltho, Jonathan P., Williams, Nicholas H. and Wittinghofer, Alfred 2017. How to name atoms in phosphates, polyphosphates, their derivatives and mimics, and transition state analogues for enzyme-catalysed phosphoryl transfer reactions (IUPAC Recommendations 2016). Pure and Applied Chemistry 89 (5) , pp. 653-675. 10.1515/pac-2016-0202
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Blackburn, George Michael, Jin, Yi, Richards, Nigel G.J. and Waltho, Jonathan P 2017. Metal fluorides as analogs for studies on phosphoryl transfer enzymes. Angewandte Chemie 129 (15) , pp. 4172-4192. 10.1002/ange.201606474
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Boateng, Isaac Wiafe, Tia, Richard, Adei, Evans, Dzade, Nelson Yaw, Catlow, Charles Richard and De Leeuw, Nora 2017. A DFT+U investigation of hydrogen adsorption on the LaFeO3 (010) surface. Physical Chemistry Chemical Physics 2017 (10) , pp. 7399-7409. 10.1039/C6CP08698E
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Boggio-Pasqua, Martial, López Vidal, Marta and Garavelli, Marco 2017. Theoretical mechanistic study of self-sensitized photo-oxygenation and singlet oxygen thermal release in a dimethyldihydropyrene derivative. Journal of Photochemistry and Photobiology A: Chemistry 333 , pp. 156-164. 10.1016/j.jphotochem.2016.10.020

Bonello, R. Owen, Pitak, Mateusz B., Coles, Simon J., Hallett, Andrew J., Fallis, Ian Andrew and Pope, Simon J. A. 2017. Synthesis and characterisation of phosphorescent rhenium(I) complexes of hydroxy- and methoxy-substituted imidazo[4,5- f ]-1,10-phenanthroline ligands. Journal of Organometallic Chemistry 841 , pp. 39-47. 10.1016/j.jorganchem.2017.04.021
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Bonifazi, Davide 2017. Versatile self-adapting boronic acids for H-bond recognition: from discrete to polymeric supramolecules. Journal of the American Chemical Society 139 (7) , pp. 2710-2727. 10.1021/jacs.6b11362
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Boorsma, Carian E., van der Veen, T. Anienke, Putri, Kurnia S. S., De Almeida, Andreia, Draijer, Christina, Mauad, Thais, Fejer, Gyorgy, Brandsma, Corry-Anke, van den Berge, Maarten, Bossé, Yohan, Sin, Don, Hao, Ke, Reithmeier, Anja, Andersson, Göran, Olinga, Peter, Timens, Wim, Casini, Angela and Melgert, Barbro N. 2017. A potent tartrate resistant acid phosphatase inhibitor to study the function of TRAP in alveolar macrophages. Scientific Reports 7 (1) , 12570. 10.1038/s41598-017-12623-w
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Bosch-Navarro, Concha, Laker, Zachary P.L., Marsden, Alexander J., Wilson, Neil R. and Rourke, Jonathan P. 2017. Non-covalent functionalization of graphene with a hydrophilic self-limiting monolayer for macro-molecule immobilization. FlatChem 1 , pp. 52-56. 10.1016/j.flatc.2016.11.001
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Bosica, Giovanna and Polidano, Kurt 2017. Solvent-free Henry and Michael reactions with nitroalkanes promoted by potassium carbonate as a versatile heterogeneous catalyst. Journal of Chemistry 2017 , 6267036. 10.1155/2017/6267036
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Bouleghlimat, Azzedine, Othman, Mazin, Lagrave, Louis, Matsuzawa, Soichiro, Nakamura, Yoshinobu, Fujii, Syuji and Buurma, Niklaas 2017. Halide-enhanced catalytic activity of palladium nanoparticles comes at the expense of catalyst recovery. Catalysts 7 (9) , 280. 10.3390/catal7090280
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Bouleghlimat, Emir 2017. Materials for the photocatalytic treatment of recalcitrant organic waste. PhD Thesis, Cardiff University.
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Brown, Kristen E., Singh, Arunoday P. N., Wu, Yi-Lin, Mishra, Ashutosh Kumar, Zhou, Jiawang, Lewis, Frederick D., Young, Ryan M. and Wasielewski, Michael R. 2017. Tracking hole transport in DNA hairpins using a phenylethynylguanine nucleobase. Journal of the American Chemical Society 139 (34) , pp. 12084-12092. 10.1021/jacs.7b06998
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Brown, Kristen E., Singh, Arunoday P. N., Wu, Yi-Lin, Ma, Lin, Mishra, Ashutosh K., Phelan, Brian T., Young, Ryan M., Lewis, Frederick D. and Wasielewski, Michael R. 2017. Fluorescent excimers and exciplexes of the purine base derivative 8-phenylethynyl-guanine in DNA hairpins. Faraday Discussions 207 , pp. 217-232. 10.1039/C7FD00186J
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Browne, Duncan L, Howard, Joseph L and Schotten, Christiane 2017. Continuous flow processing as a tool for medicinal chemical synthesis. Comprehensive Medicinal Chemistry III, Elsevier, pp. 135-185. (10.1016/B978-0-12-409547-2.12288-7)

Bryant, M. J., Skelton, J. M., Hatcher, L. E., Stubbs, C., Madrid, E., Pallipurath, A. R., Thomas, L. H., Woodall, C. H., Christensen, J., Fuertes, S., Robinson, T. P., Beavers, C. M., Teat, S. J., Warren, M. R., Pradaux-Caggiano, F., Walsh, A., Marken, F., Carbery, D. R., Parker, S. C., McKeown, N. B., Malpass-Evans, R., Carta, M. and Raithby, P. R. 2017. A rapidly-reversible absorptive and emissive vapochromic Pt(II) pincer-based chemical sensor. Nature Communications 8 , 1800. 10.1038/s41467-017-01941-2
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Bugler, Keith 2017. The catalytic oxidative dehydrogenation of n-octane over iron and other metal molybdates. PhD Thesis, Cardiff University.
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Buurma, Niklaas J. 2017. Aggregation and reactivity in aqueous solutions of cationic surfactants and aromatic anions across concentration scales. Current Opinion in Colloid & Interface Science 32 , pp. 69-75. 10.1016/j.cocis.2017.10.005
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Buurma, Niklaas J. 2017. π-conjugated DNA binders. In: Stulz, Eugen and Clever, Guido H. eds. Supramolecular Chemistry and Nanotechnology, Wiley, ch1.2. (10.1002/9781118696880.ch1.2)

C

Cadi-Essadek, A., Roldan Martinez, Alberto and De Leeuw, Nora 2017. Density functional theory study of Ni clusters supported on the ZrO2 (111) surface. Fuel Cells 17 (2) , pp. 125-131. 10.1002/fuce.201600044
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Cao, Enhong, Brett, Gemma Louise, Miedziak, Peter John, Douthwaite, John, Barrass, Simon, McMillan, Paul F., Hutchings, Graham John and Gavriilidis, Asterios 2017. A micropacked-bed multi-reactor system with in situ raman analysis for catalyst evaluation. Catalysis Today 283 , pp. 195-201. 10.1016/j.cattod.2016.06.007
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Cao, Tao, Wu, Mengjia, Ordomsky, Vitaly V., Xin, Xi, Wang, Hao, Métivier, Pascal and Pera-Titus, Marc 2017. Selective electrogenerative oxidation of 5-hydroxymethylfurfural to 2,5-furandialdehyde. ChemSusChem 10 (24) , pp. 4851-4854. 10.1002/cssc.201702119

Cao, Ting, Zhang, Fangting, Cai, Liangyuan, Zhou, Yinglin, Buurma, Niklaas J. and Zhang, Xinxiang 2017. Investigation of the interactions between methylene blue and intramolecular G-quadruplexes: an explicit distinction in electrochemical behavior. Analyst 2017 (142) , pp. 987-993. 10.1039/C7AN00083A
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Cao, Yueling, Iqbal, Sarwat, Miedziak, Peter John, Jones, Daniel R., Morgan, David John, Liu, Xi, Wang, Junwei and Hutchings, Graham 2017. An investigation into bimetallic catalysts for base free oxidation of cellobiose and glucose. Journal of Chemical Technology and Biotechnology 92 (9) , pp. 2246-2253. 10.1002/jctb.5287
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Carpenter, Barry K., Ezra, Gregory S., Farantos, Stavros C., Kramer, Zeb C. and Wiggins, Stephen 2017. Empirical classification of trajectory data: An opportunity for the use of machine learning in molecular dynamics. Journal of Physical Chemistry B 122 (13) , p. 3230. 10.1021/acs.jpcb.7b08707
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Carta, Mariolina, Bezzu, C. Grazia, Vile, James, Kariuki, Benson M. and McKeown, Neil B 2017. Polymers of Intrinsic Microporosity derived from a carbocyclic analogue of Tröger's base. Polymer 126 , pp. 324-329. 10.1016/j.polymer.2017.03.037
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Carter, Korey P., Pope, Simon J. A., Kalaj, Mark, Holmberg, Rebecca J., Murugesu, Muralee and Cahill, Christopher L. 2017. Exploring the promotion of synthons of choice: halogen bonding in molecular lanthanide complexes characterized via X-ray diffraction, luminescence spectroscopy, and magnetic measurements. Zeitschrift für ganische und allgemeine Chemie 643 (23) , pp. 1948-1955. 10.1002/zaac.201700341
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Casini, Angela, Estrada-Ortiz, Natalia, Gabbiani, Chiara, Guarra, Federica, Groothuis, Geny, de Graaf, Inge, de Jager, Marina and Marchetti, Lorella 2017. Anticancer gold N-heterocyclic carbene complexes: a comparative in vitro and ex vivo study. ChemMedchem 12 (17) , pp. 1429-1435. 10.1002/cmdc.201700316
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University of Groningen 2017. Gold(III) compounds as tartrate resistant acid phosphatase inhibitors, and therapeutic uses thereof. WO2017058012 (A1). [Patent].

Casini, Angela, Miller, Jessica J., Gomes, Luiza M.F. and Storr, Tim 2017. The interaction of metal compounds with protein targets: new tools in medicinal chemistry and chemical biology. Encyclopedia of Inorganic and Bioinorganic Chemistry, Wiley, (10.1002/9781119951438)

Casini, Angela, Orvig, Chris and Correia, João D. G. 2017. Frontiers in radionuclide imaging and therapy, a chemical journey from naturally radioactive elements to targeted theranostic agents. Dalton Transactions 46 , pp. 14433-14434. 10.1039/C7DT90181J
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Casini, Angela, Woods, Benjamin and Wenzel, Margot 2017. The promise of self-assembled 3D supramolecular coordination complexes for biomedical applications. Inorganic Chemistry 56 (24) , pp. 14715-14729. 10.1021/acs.inorgchem.7b02599
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Caswell, Thomas 2017. Photocatalytic nitrate reduction under solar-simulated light using modified TiO2. PhD Thesis, Cardiff University.
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Catlow, C. Richard 2017. Modelling and simulation in the science of micro- and meso-porous materials. Elsevier.

Catlow, C. Richard 2017. Peer reviewers need more nurturing. Nature 552 (7685) , p. 293. 10.1038/d41586-017-08289-z
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Catlow, C. Richard A., van Santen, Rutger A. and Van Speybroeck, Veronique 2017. Preface. In: Catlow, C. Richard A., Van Speybroeck, Veronique and Van Santen, Rutger A. eds. Modelling and Simulation in the Science of Micro- and Meso-Porous Materials, Elsevier, xiii. (10.1016/B978-0-12-805057-6.00013-2)

Catlow, Charles Richard 2017. Developments in the structural science of materials. IUCrJ 4 (3) , pp. 199-201. 10.1107/S2052252517006145
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Celorrio, V., Morris, Louis J., Cattelan, M., Fox, N.A. and Fermin, D.J. 2017. Tellurium-doped lanthanum manganite as catalysts for the oxygen reduction reaction. MRS Communications 7 (2) , pp. 193-198. 10.1557/mrc.2017.22
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Cerrato, Erik, Gionco, Chiara, Paganini, Maria Cristina and Giamello, Elio 2017. Photoactivity properties of ZnO doped with cerium ions: an EPR study. Journal of Physics: Condensed Matter 29 (44) , 444001. 10.1088/1361-648X/aa88f7

Chan-Thaw, Carine, Chinchilla, Lidia, Sanchez Trujillo, Felipe Juan, Dimitratos, Nikolaos, Botton, Gianluigi, Prati, Laura and Villa, Alberto 2017. Enhanced activity of Au/NiO nanohybrids for the reductive amination of benzyl alcohol. Materials 10 (12) , 1435. 10.3390/ma10121435
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Charalampopoulos, Vasileios G., Kariuki, Benson and Harris, Kenneth David Maclean 2017. Complexes of Thiourea with alkali metal bromides and iodides: Structural properties, mixed-halide and mixed-metal materials, and halide exchange processes. Crystal Growth and Design 17 (2) , pp. 786-793. 10.1021/acs.cgd.6b01644
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Chhantyal-Pun, Rabi, McGillen, Max R., Beames, Joseph, Khan, M. Anwar H., Percival, Carl J., Shallcross, Dudley E. and Orr-Ewing, Andrew J. 2017. Temperature-dependence of the rates of reaction of trifluoroacetic acid with criegee intermediates. Angewandte Chemie - International Edition 56 (31) , pp. 9044-9047. 10.1002/anie.201703700
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Christie, J. K. and De Leeuw, Nora 2017. Effect of strontium inclusion on the bioactivity of phosphate-based glasses. Journal of Materials Science 52 (15) , pp. 9014-9022. 10.1007/s10853-017-1155-x
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Christie, Jamieson K., Ainsworth, Richard I, Ruiz Hernandez, Sergio Ernesto and De Leeuw, Nora Henriette 2017. Structures and properties of phosphate-based bioactive glasses from computer simulation: a review. Journal of Materials Chemistry B 5 (27) , pp. 5297-5306. 10.1039/C7TB01236E
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Chutia, Arunabhiram, Gibson, Emma K., Farrow, Matthew R., Wells, Peter P., Scanlon, David O., Dimitratos, Nikolaos, Willock, David and Catlow, Charles Richard A. 2017. The adsorption of Cu on the CeO2(110) surface. Physical Chemistry Chemical Physics 19 (40) , pp. 27191-27203. 10.1039/C7CP04144F
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Clark, Nicholas, Shaw, Greg and Porch, Adrian 2017. Effect of surface stresses on microwave surface resistance and its impact for cavity perturbation measurements. IEEE Microwave and Wireless Components Letters 27 (10) , pp. 939-941. 10.1109/LMWC.2017.2745486
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Constantinides, Christos P., Carter, Emma, Eisler, Dana, Beldjoudi, Yassine, Murphy, Damien Martin and Rawson, Jeremy M. 2017. Effects of Halo-substitution on 2'-Chloro-5'-halo-phenyl-1,2,3,5-dithiadiazolyl Radicals: A Crystallographic, Magnetic and EPR Case Study. Crystal Growth and Design 17 (6) , pp. 3017-3029. 10.1021/acs.cgd.6b01700
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Cooper, Bridgette, Girdlestone, Stephen, Burovskiy, Pavel, Gaydadjiev, Georgi, Averbukh, Vitali, Knowles, Peter J. and Luk, Wayne 2017. Quantum chemistry in dataflow: Density-fitting MP2. Journal of Chemical Theory and Computation 13 (11) , pp. 5265-5272. 10.1021/acs.jctc.7b00649
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Cortese, Remedios, Schimmenti, Roberto, Ferrante, Francesco, Prestianni, Antonio, Decarolis, Donato and Duca, Dario 2017. Graph-based analysis of ethylene glycol decomposition on a palladium cluster. Journal of Physical Chemistry C 121 (25) , pp. 13606-13616. 10.1021/acs.jpcc.7b00850
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Craco, L., Faria, J. L. B. and Leoni, Stefano 2017. Electronic reconstruction of hexagonal FeS: a view from density functional dynamical mean-field theory. Materials Research Express 4 (3) , 036303. 10.1088/2053-1591/aa6296
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Di Tommaso, Devis, Prakash, Muthuramalingam, Lemaire, Thibault, Lewerenz, Marius, De Leeuw, Nora and Naili, Salah 2017. Molecular dynamics simulations of hydroxyapatite nanopores in contact with electrolyte solutions: the effect of nanoconfinement and solvated ions on the surface reactivity and the structural, dynamical, and vibrational properties of water. Crystals 7 (2) , 57. 10.3390/cryst7020057
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Diwate, Kiran, Mohite, Kakasaheb, Shinde, Manish, Rondiya, Sachin, Pawbake, Amit, Date, Abhijit, Pathan, Habib and Jadkar, Sandesh 2017. Synthesis and characterization of chemical spray [yrolysed CZTS thin films for solar cell applications. Energy Procedia 110 , pp. 180-187. 10.1016/j.egypro.2017.03.125
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Dosso, Jacopo, Tasseroul, Jonathan, Fasano, Francesco, Marinelli, Davide, Biot, Nicolas, Fermi, Andrea and Bonifazi, Davide 2017. Synthesis and optoelectronic properties of hexa-peri -hexabenzoborazinocoronene. Angewandte Chemie 129 (16) , pp. 4554-4558. 10.1002/ange.201700907
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El-Hiti, Gamal A., Abdel-Wahab, Bakr F., Alotaibi, Mohammad Hayal, Hegazy, Amany S. and Kariuki, Benson M. 2017. 1-[5-Methyl-1-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]ethanone. IUCrData 2 (12) 10.1107/S2414314617017825
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El-Hiti, Gamal A., Abdel-Wahab, Bakr F., Alotaibi, Mohammad Hayal, Hegazy, Amany S. and Kariuki, Benson M. 2017. Methyl 5-(1-benzofuran-2-yl)isoxazole-3-carboxylate. IUCrData 2 (12) 10.1107/S241431461701820X
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El-Hiti, Gamal A., Abdel-Wahab, Bakr F., Alshammari, Mohammed B., Hegazy, Amany S. and Kariuki, Benson M. 2017. Crystal structure of (E)-3-methyl-4-((3-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1-phenyl-1H-pyrazol-4-yl)methylene)-1-phenyl-1H-pyrazol-5(4H)-one, C29H23N7O. Zeitschrift für Kristallographie - New Crystal Structures 232 (2) , pp. 291-293. 10.1515/ncrs-2016-0243
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El-Hiti, Gamal A., Abdel-Wahab, Bakr F., Baashen, Mohammed, Hegazy, Amany S. and Kariuki, Benson M. 2017. Crystal structure of (E)-5-((4-chlorophenyl)diazenyl)-2-(5-(4-fluorophenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl)-4-methylthiazole, C23H17ClFN5S2. Zeitschrift für Kristallographie - New Crystal Structures 232 (1) 10.1515/ncrs-2016-0208
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El-Hiti, Gamal A., Abdel-Wahab, Bakr F., Baashen, Mohammed, Hegazy, Amany S. and Kariuki, Benson M. 2017. Crystal structure of 3-(5-methyl-1-p-tolyl-1H-1,2,3-triazol-4-yl)-1-phenyl-1H-pyrazole-4-carbaldehyde, a rare Z' = 3 structure, C20H17N5O. Zeitschrift für Kristallographie - New Crystal Structures 232 (2) , pp. 313-315. 10.1515/ncrs-2016-0258
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El-Hiti, Gamal A., Abdel-Wahab, Bakr F., Hegazy, Amany S and Kariuki, Benson 2017. Crystal structure of 5-(5-(4-chlorophenyl)-1-phenyl-1H-pyrazol-3-yl)-N-phenyl-1,3,4-thiadiazol-2-amine, C23H16ClN5S. Zeitschrift für Kristallographie - New Crystal Structures 232 (2) , pp. 317-319. 10.1515/ncrs-2016-0259
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El-Hiti, Gamal A., Abdel-Wahab, Bakr F., Hegazy, Amany S., Alamri, Mesfer and Kariuki, Benson M. 2017. Crystal structure of 2-((3-(5-methyl-1-phenyl-1H-1,2,3-triazol-4-yl)-1-phenyl-1H-pyrazol-4-yl)methylene)-1H-indene-1,3(2H)-dione, C28H19N5O2. Zeitschrift für Kristallographie - New Crystal Structures 232 (1) , pp. 19-20. 10.1515/ncrs-2016-0108
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El-Hiti, Gamal A., Abdel-Wahab, Bakr F., Hegazy, Amany S. and Kariuki, Benson M. 2017. Crystal structure of (E)-2-(5-(4-fluorophenyl)-3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl)-5-((4-fluorophenyl)diazenyl)-4-methylthiazole, C23H17F2N5OS. Zeitschrift für Kristallographie - New Crystal Structures 232 (3) , pp. 413-415. 10.1515/ncrs-2016-0293
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El-Hiti, Gamal A., Smith, Keith, Alamri, Mesfer, Morris, Ceri A., Kariuki, Benson and Kille, Peter 2017. Crystal structure of 2-(bis(4-methoxyphenyl)amino)-2-oxoacetic acid, C16H15NO5. Zeitschrift für Kristallographie - New Crystal Structures 232 (2) 10.1515/ncrs-2016-0325
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El-Hiti, Gamal A., Smith, Keith, Alshammari, Mohammed B., Hegazy, Amany S. and Kariuki, Benson 2017. Crystal structure of 3-(4-chlorophenyl)-1,1-dimethylthiourea, C9H11ClN2S. Zeitschrift für Kristallographie - New Crystal Structures 232 (1) , pp. 105-108. 10.1515/ncrs-2016-0171
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El-Hiti, Gamal A., Smith, Keith, Hegazy, Amany S., Hayal Alotaibi, Mohammad and Kariuki, Benson M. 2017. Crystal structure of 3-(2-bromophenyl)-1,1-dimethylthiourea, C9H11BrN2S. Zeitschrift für Kristallographie - New Crystal Structures 232 (1) , pp. 31-32. 10.1515/ncrs-2016-0116
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Evans, Christopher Dean 2017. Glycerol oxidation: An investigation into the control of product distribution and mechanistic pathways using novel supports. PhD Thesis, Cardiff University.
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Everett, M. and Wass, D. F. 2017. Highly productive CO2 hydrogenation to methanol – a tandem catalytic approach via amide intermediates. Chemical Communications 53 (68) , pp. 9502-9504. 10.1039/C7CC04613H
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Ghosh, S., Xie, M., Bowen, C.R., Davies, P.R., Morgan, D.J. and Mandal, D. 2017. A hybrid strain and thermal energy harvester based on an infra-red sensitive Er3+ modified poly(vinylidene fluoride) ferroelectret structure. Scientific Reports 7 (1) , 16703. 10.1038/s41598-017-16822-3
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Gibson, Emma K., Stere, Cristina E., Curran-McAteer, Bronagh, Jones, Wilm, Cibin, Giannantonio, Gianolio, Diego, Goguet, Alexandre, Wells, Peter P., Catlow, C. Richard A., Collier, Paul, Hinde, Peter and Hardacre, Christopher 2017. Probing the role of a non-thermal plasma (NTP) in the hybrid NTP catalytic oxidation of methane. Angewandte Chemie International Edition 56 (32) , pp. 9351-9355. 10.1002/anie.201703550
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Giorgi, Pascal D., Miedziak, Peter J., Edwards, Jennifer K., Hutchings, Graham J. and Antoniotti, Sylvain 2017. Bicatalytic multistep reactions en route to the one-pot total synthesis of complex molecules: easy access to chromene and 1,2-dihydroquinoline derivatives from simple substrates. ChemCatChem 9 (1) , pp. 70-75. 10.1002/cctc.201600925
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Girasolo, Maria Assunta, Tesoriere, Luisa, Casella, Girolamo, Attanzio, Alessandro, Capobianco, Massimo L., Sabatino, Piera, Barone, Giampaolo, Rubino, Simona and Bonsignore, Riccardo 2017. A novel compound of triphenyltin(IV) with N-tert-butoxycarbonyl-L-ornithine causes cancer cell death by inducing a p53-dependent activation of the mitochondrial pathway of apoptosis. Inorganica Chimica Acta 456 , pp. 1-8. 10.1016/j.ica.2016.11.012

Goswami, Subhadip, Miller, Claire E., Logsdon, Jenna L., Buru, Cassandra T., Wu, Yi-Lin, Bowman, David N., Islamoglu, Timur, Asiri, Abdullah M., Cramer, Christopher J., Wasielewski, Michael R., Hupp, Joseph T. and Farha, Omar K. 2017. Atomistic approach toward selective photocatalytic oxidation of a mustard-gas simulant: A case study with heavy-chalcogen-containing PCN-57 analogues. ACS Applied Materials and Interfaces 9 (23) , pp. 19535-19540. 10.1021/acsami.7b07055
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Graziani, Valentina, Marrone, Alessandro, Re, Nazzareno, Coletti, Cecilia, Platts, James A. and Casini, Angela 2017. A multilevel theoretical study to disclose the binding mechanisms of gold(III) bipyridyl compounds as selective aquaglyceroporin inhibitors. Chemistry - a European Journal 23 (55) , pp. 13802-13813. 10.1002/chem.201703092
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Groves, Lara M., Schotten, Christiane, Beames, Joseph, Platts, James A., Coles, Simon J., Horton, Peter N., Browne, Duncan L. and Pope, Simon J. A. 2017. From ligand to phosphor: rapid, machine-assisted synthesis of substituted iridium(III) pyrazolate complexes with tuneable luminescence. Chemistry - A European Journal 23 (39) , pp. 9407-9418. 10.1002/chem.201701551
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Guadix Montero, Susana, Alshammari, Hamed, Dalebout, Remco, Nowicka, Ewa, Morgan, David J., Shaw, Greg, He, Qian and Meenakshisundaram, Sankar 2017. Deactivation studies of bimetallic AuPd nanoparticles supported on MgO during selective aerobic oxidation of alcohols. Applied Catalysis A: General 546 , pp. 58-66. 10.1016/j.apcata.2017.07.045
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Lupan, Oleg, Postica, Vasile, Gröttrup, Jorit, Mishra, Abhishek K., De Leeuw, Nora and Adelung, Rainer 2017. Enhanced UV and ethanol vapour sensing of a single 3-D ZnO tetrapod alloyed with Fe2O3 nanoparticles. Sensors and Actuators B: Chemical 245 , pp. 448-461. 10.1016/j.snb.2017.01.107
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Malhotra, Shashwat, Singh, Seema, Rana, Neha, Tomar, Shilpi, Bhatnagar, Priyanka, Gupta, Mohit, Singh, Suraj K., Singh, Brajendra K., Chhillar, Anil K., Prasad, Ashok K., Len, Christophe, Kumar, Pradeep, Gupta, Kailash C., Varma, Anjani J., Kuhad, Ramesh C., Sharma, Gainda L., Parmar, Virinder S. and Richards, Nigel 2017. Chemoenzymatic synthesis, nanotization and anti- aspergillus activity of optically enriched fluconazole analogues. Antimicrobial Agents and Chemotherapy 61 (8) , e00273-17. 10.1128/AAC.00273-17
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Malmedy, Florence and Wirth, Thomas 2017. Cyclization of malonate derivatives with iodine(III) reagents. European Journal of Organic Chemistry 10.1002/ejoc.201601587
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Paul, Alison, Clark, J. N., Salama, I. E., Jenkins, B. J., Goodwin, N., Wilkes, A. R., Mahoney, P. F. and Hall, Judith Elizabeth 2017. Laboratory evaluation of a novel anaesthesia delivery device. Anaesthesia 72 (1) , pp. 63-72. 10.1111/anae.13625
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Pizzutilo, Enrico, Freakley, Simon J., Cherevko, Serhiy, Venkatesan, Sriram, Hutchings, Graham John, Liebscher, Christian H., Dehm, Gerhard and Mayrhofer, Karl J. J. 2017. Gold-palladium bimetallic catalyst stability: consequences for hydrogen peroxide selectivity. ACS Catalysis 7 , pp. 5699-5705. 10.1021/acscatal.7b01447
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Polyak, Iakov, Bearpark, Michael J. and Robb, Michael A. 2017. Application of the unitary group approach to evaluate spin density for configuration interaction calculations in a basis of S2 eigenfunctions 2 eigenfunctions. International Journal of Quantum Chemistry 2017 , e25559. 10.1002/qua.25559
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Pope, Simon J. A., Langdon-Jones, Emily, Jones, Ariana, Williams, Catrin Ffion, Hayes, Anthony Joseph, Lloyd, David and Mottram, Huw James 2017. Anticancer, azonafide-inspired fluorescent ligands and their rhenium(I) complexes for cellular imaging. European Journal of Inorganic Chemistry 2017 (3) , pp. 759-766. 10.1002/ejic.201601271
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Postica, Vasile, Gröttrup, Jorit, Adelung, Rainer, Lupan, Oleg, Mishra, Abhishek Kumar, De Leeuw, Nora, Ababii, Nicolai, Carreira, José F. C., Rodrigues, Joana, Sedrine, Nebiha Ben, Correia, Maria Rosário, Monteiro, Teresa, Sontea, Victor and Mishra, Yogendra Kumar 2017. Multifunctional materials: A case study of the effects of metal doping on ZnO Tetrapods with bismuth and tin oxides. Advanced Functional Materials 27 (6) , 1604676. 10.1002/adfm.201604676
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Potter, Matthew E., Chapman, Stephanie, O'Malley, Alexander, Levy, Alan, Carravetta, Marina, Mezza, Thomas M., Parker, Stewart F. and Raja, Robert 2017. Understanding the role of designed solid acid sites in the low-temperature production of ϵ-Caprolactam. ChemCatChem 9 (11) , pp. 1897-1900. 10.1002/cctc.201700516
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Prakash, Muthuramalingam, Lemaire, Thibault, Caruel, Matthieu, Lewerenz, Marius, de Leeuw, Nora H., Di Tommaso, Devis and Naili, Salah 2017. Anisotropic diffusion of water molecules in hydroxyapatite nanopores. Physics and Chemistry of Minerals 44 (7) , pp. 509-519. 10.1007/s00269-017-0878-1
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Reguera, Leslie, López, Noeldris L., Rodríguez-Hernández, Joelis, González, Marlene, Hernandez-Tamargo, Carlos E., Santos Carballal, David, De Leeuw, Nora and Reguera, Edilso 2017. Synthesis, crystal structures, and properties of Zeolite-Like T3 (H3 O)2 [M(CN)6 ]2 ·u H2 O (T = Co, Zn; M = Ru, Os). European Journal of Inorganic Chemistry 2017 (23) , pp. 2980-2989. 10.1002/ejic.201700278
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Roldan Martinez, Alberto and De Leeuw, Nora 2017. A kinetic model of water adsorption, clustering and dissociation on the Fe3S4{001} surface. Physical Chemistry Chemical Physics 19 , pp. 12045-12055. 10.1039/C6CP07371A
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Rondiya, Sachin, Rokade, Avinash, Gabhale, Bharat, Pandharkar, Subhash, Chaudhari, Madhavi, Date, Abhijit, Chaudhary, Minakshi, Pathan, Habib and Jadkar, Sandesh 2017. Effect of bath temperature on optical and morphology properties of CdS thin films grown by chemical bath deposition. Energy Procedia 110 , pp. 202-209. 10.1016/j.egypro.2017.03.128
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Stokes, Emily C. 2017. Amphiphilic ligand architectures for s-, d- and f-block metallosurfactants towards micellar systems and microemulsions. PhD Thesis, Cardiff University.
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Subaihi, Abdu, Muhamadali, Howbeer, Mutter, Shaun T, Blanch, Ewan, Ellis, David I. and Goodacre, Royston 2017. Quantitative detection of codeine in human plasma using surface-enhanced Raman scattering via adaptation of the isotopic labelling principle. Analyst 142 (7) , pp. 1099-1105. 10.1039/C7AN00193B
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Vallotto, C., Williams, H. E., Murphy, Damien M., Ayres, Z.J., Edge, R., Newton, M.E. and Wedge, C.J. 2017. An Electron Paramagnetic Resonance (EPR) spectroscopy study on the γ-irradiation sterilization of the pharmaceutical excipient l-histidine: Regeneration of the radicals in solution. International Journal of Pharmaceutics 533 (1) , pp. 315-319. 10.1016/j.ijpharm.2017.09.068
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Wilkins, Lewis C., Howard, Joseph L., Burger, Stefan, Frentzel-Beyme, Louis, Browne, Duncan L. and Melen, Rebecca L. 2017. Exploring multistep continuous-flow hydrosilylation reactions catalyzed by tris(pentafluorophenyl)borane. Advanced Synthesis and Catalysis 359 (15) , pp. 2580-2584. 10.1002/adsc.201700349
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Wu, Liang, Jiang, Jianbing, Jin, Yi, Kallemeijn, Wouter W., Kuo, Chi-Lin, Artola, Marta, Dai, Wei, van Elk, Cas, van Eijk, Marco, van der Marel, Gijsbert A., Codée, Jeroen D. C., Florea, Bogdan I., Aerts, Johannes M. F. G., Overkleeft, Herman S. and Davies, Gideon J. 2017. Activity-based probes for functional interrogation of retaining β-glucuronidases. Nature Chemical Biology 13 , pp. 867-873. 10.1038/nchembio.2395
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Wu, Yi-Lin, Horwitz, Noah E., Chen, Kan-Sheng, Gomez-Gualdron, Diego A., Luu, Norman S., Ma, Lin, Wang, Timothy C., Hersam, Mark C., Hupp, Joseph T., Farha, Omar K., Snurr, Randall Q. and Wasielewski, Michael R. 2017. G-quadruplex organic frameworks. Nature Chemistry 9 , 466–472. 10.1038/nchem.2689
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Xu, Shaojun, Whitehead, J. Christopher and Martin, Philip A. 2017. CO2 conversion in a non-thermal, barium titanate packed bed plasma reactor: the effect of dilution by Ar and N2l, barium titanate packed bed plasma reactor: the effect of dilution by Ar and N 2. Chemical Engineering Journal 327 , pp. 764-773. 10.1016/j.cej.2017.06.090

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Yang, Zhou, Lu, Li, Kiely, Christopher J., Berger, Bryan W. and McIntosh, Steven 2017. Single enzyme direct biomineralization of CdSe and CdSe-CdS core-shell quantum dots. ACS Applied Materials and Interfaces 9 (15) , pp. 13430-13439. 10.1021/acsami.7b00133
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Yao, Siyu, Zhang, Xiao, Zhou, Wu, Gao, Rui, Xu, Wenqian, Ye, Yifan, Lin, Lili, Wen, Xiaodong, Liu, Ping, Chen, Bingbing, Crumlin, Ethan, Guo, Jinghua, Zuo, Zhijun, Li, Weizhen, Xie, Jinglin, Lu, Li, Kiely, Christopher J., Gu, Lin, Shi, Chuan, Rodriguez, José A. and Ma, Ding 2017. Atomic-layered Au clusters on α-MoC as catalysts for the low-temperature water-gas shift reaction. Science 357 (6349) , pp. 389-393. 10.1126/science.aah4321
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Yenchalwar, Sandeep G., Rondiya, Sachin R., Shinde, Pravin N., Jadkar, Sandesh R. and Shelke, M. V. 2017. Optical antenna effect on SiNWs/CuS photodiodes. physica status solidi (a) 214 (5) , 1600635. 10.1002/pssa.201600635

Yevglevskis, Maksims, Lee, Guat L., Nathubhai, Amit, Petrova, Yoana D., James, Tony D., Threadgill, Michael D., Woodman, Timothy J. and Lloyd, Matthew D. 2017. A novel colorimetric assay for α-methylacyl-CoA racemase 1A (AMACR; P504S) utilizing the elimination of 2,4-dinitrophenolate. Chemical Communications 53 (37) , pp. 5087-5090. 10.1039/C7CC00476A
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Yin, Qin, Soltani, Yashar, Melen, Rebecca and Oestreich, Martin 2017. BArF3-catalyzed imine hydroboration with pinacolborane not requiring the assistance of an additional Lewis base. Organometallics 36 (13) , pp. 2381-2384. 10.1021/acs.organomet.7b00381
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Yoshida, Rei, Sun, Daolai, Yamada, Yasuhiro, Sato, Satoshi and Hutchings, Graham John 2017. Vapor-phase hydrogenation of levulinic acid to γ-valerolactone over Cu-Ni bimetallic catalysts. Catalysis Communications 97 , pp. 79-82. 10.1016/j.catcom.2017.04.018
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Zeinalipour-Yazdi, Constantinos D. and Catlow, Charles Richard 2017. A computational study of the heterogeneous synthesis of hydrazine on Co3Mo3N. Catalysis Letters 147 (7) , pp. 1820-1826. 10.1007/s10562-017-2080-y
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Zeinalipour-Yazdi, Constantinos D., Hargreaves, Justin S. J., Laassiri, Said and Catlow, Charles Richard 2017. DFT-D3 study of H2 and N2 chemisorption over cobalt promoted Ta3N5-(100), (010) and (001) surfaces. Physical Chemistry Chemical Physics 19 , pp. 11968-11974. 10.1039/C7CP00806F
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Zhao, Liang, Kong, Liping, Liu, Chunze, Wang, Yuanyuan and Dai, Liyi 2017. AgCu/SiC-powder: A highly stable and active catalyst for gas-phase selective oxidation of alcohols. Catalysis Communications 98 , pp. 1-4. 10.1016/j.catcom.2017.04.043

Zheng, Chunli, Wang, Qiaorui, Ning, Yanli, Fan, Yurui, Feng, Shanshan, He, Chi, Zhang, Tian C. and Shen, Zhenxing 2017. Isolation of a 2-picolinic acid-assimilating bacterium and its proposed degradation pathway. Bioresource Technology 245 , pp. 681-688. 10.1016/j.biortech.2017.09.031
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Zhou, Wu, Soultanidis, Nikolaos, Xu, Hui, Wong, Michael S., Neurock, Matthew, Kiely, Christopher J. and Wachs, Israel E. 2017. Nature of catalytically active sites in the supported WO3/ZrO2 solid acid system: a current perspective. ACS Catalysis 7 (3) , pp. 2181-2198. 10.1021/acscatal.6b03697
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Zhu, Wen and Richards, Nigel G. J. 2017. Biological functions controlled by manganese redox changes in mononuclear Mn-dependent enzymes. Essays in Biochemistry 61 (2) , pp. 259-270. 10.1042/EBC20160070
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Zilka, Miri, Dudenko, Dmytro V, Hughes, Colan, Williams, Philip, Sturniolo, Simone, Franks, W. Trent, Pickard, Chris J., Yates, Jonathan R., Harris, Kenneth and Brown, Steven P. 2017. Ab initio random structure searching of organic molecular solids: assessment and validation against experimental data. Physical Chemistry Chemical Physics 19 (38) , pp. 25949-25960. 10.1039/C7CP04186A
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