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Aljuaid, N., Seitsonen, J., Ruokolainen, J., Greco, F. ORCID: https://orcid.org/0000-0001-7934-0056 and Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2022) Micelle and nanotape formation of Benzene Tricarboxamide analogues with selective cancer cell cytotoxicity. ACS Omega, 7 (50). pp. 46843-46848. ISSN 2470-1343 doi: https://doi.org/10.1021/acsomega.2c05940

Antunes, L. M. ORCID: https://orcid.org/0000-0002-4867-5635, Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 and Butler, K. T. ORCID: https://orcid.org/0000-0001-5432-5597 (2022) Distributed representations of atoms and materials for machine learning. npj Computational Materials, 8 (1). 44. ISSN 2057-3960 doi: https://doi.org/10.1038/s41524-022-00729-3

Antunes, L. M., Vikram, V., Plata, J. J., Powell, A. V., Butler, K. T. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2022) Machine learning approaches for accelerating the discovery of thermoelectric materials. In: An, Y. (ed.) Machine Learning in Materials Informatics: Methods and Applications. American Chemical Society, Washington, DC, pp. 1-32. ISBN 9780841297630 doi: https://doi.org/10.1021/bk-2022-1416.ch001

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Bag, R. ORCID: https://orcid.org/0000-0001-8378-053X, Sikdar, Y. ORCID: https://orcid.org/0000-0002-1146-9950, Sahu, S., Bag, J. ORCID: https://orcid.org/0000-0002-7087-0867, Drew, M. G. B., Pal, K. ORCID: https://orcid.org/0000-0003-4422-6450 and Goswami, S. ORCID: https://orcid.org/0000-0002-1045-2508 (2022) Strategic substitution of −OH/−NR 2 (R=Et, Me) imparts colorimetric switching between F − and Hg 2+ by salicyaldehyde/benzaldehyde‐quinoxaline conjugates. ChemPhysChem, 23 (4). e202100718. ISSN 1439-7641 doi: https://doi.org/10.1002/cphc.202100718

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Basham, V., Hancock, T., McKendrick, J. ORCID: https://orcid.org/0000-0003-2275-0569, Tessarolo, N. and Wicking, C. (2022) Detailed chemical analysis of a fully formulated oil using dielectric barrier discharge ionisation-mass spectrometry. Rapid Communications in Mass Spectrometry, 36 (14). e9320. ISSN 1097-0231 doi: https://doi.org/10.1002/rcm.9320

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Carrillo-Berdugo, I., Sampalo-Guzmán, J., Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719, Zorrilla, D. and Navas, J. (2022) Interface chemistry effects in nanofluids: Experimental and computational study of oil-based nanofluids with gold nanoplates. Journal of Molecular Liquids, 362. 119762. ISSN 0167-7322 doi: https://doi.org/10.1016/j.molliq.2022.119762

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Castelletto, V., de Mello, L. ORCID: https://orcid.org/0000-0001-7630-5087, Arfara, F., Iatrou, H. ORCID: https://orcid.org/0000-0001-9358-0769, Seitsonen, J. and Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2022) Influence of polymer molar mass and mixture stoichiometry on polyelectrolyte complexes of poly(l-arginine) and Poly(l-glutamic acid). Polymer, 263. 125497. ISSN 0032-3861 doi: https://doi.org/10.1016/j.polymer.2022.125497

Challen, B. and Cramer, R. ORCID: https://orcid.org/0000-0002-8037-2511 (2022) Advances in ionisation techniques for mass spectrometry‐based omics research. Proteomics, 22 (15-16). 2100394. ISSN 1615-9853 doi: https://doi.org/10.1002/pmic.202100394

Chen, H., Hart, L. R., Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 and Siviour, C. R. (2022) Experimental characterisation and modelling of the strain rate dependent mechanical response of a filled thermo-reversible supramolecular polyurethane. International Journal of Impact Engineering, 166. 104239. ISSN 0734-743X doi: https://doi.org/10.1016/j.ijimpeng.2022.104239

Clarke, C. J. ORCID: https://orcid.org/0000-0003-2698-3490, Baaqel, H., Matthews, R. P. ORCID: https://orcid.org/0000-0003-3328-4954, Chen, Y., Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X, Hallett, J. P. ORCID: https://orcid.org/0000-0003-3431-2371 and Licence, P. ORCID: https://orcid.org/0000-0003-2992-0153 (2022) Halometallate ionic liquids: thermal properties, decomposition pathways, and life cycle considerations. Green Chemistry, 24 (15). pp. 5800-5812. ISSN 1463-9270 doi: https://doi.org/10.1039/d2gc01983c

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Dalla Pozza, M., Abdullrahman, A., Cardin, C. J. ORCID: https://orcid.org/0000-0002-2556-9995, Gasser, G. and Hall, J. P. ORCID: https://orcid.org/0000-0003-3716-4378 (2022) Three’s a crowd – stabilisation, structure, and applications of DNA triplexes. Chemical Science (35). pp. 10193-10215. ISSN 2041-6539 doi: https://doi.org/10.1039/d2sc01793h

Das, C., Mondal, A., Sengupta, S., Cardin, C. ORCID: https://orcid.org/0000-0002-2556-9995 and Chattopadhyay, S. K. (2022) Selective cyanide sensing using a Fe(III) complex of pyridoxal-beta alanine Schiff base. Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy, 273. 120943. ISSN 1386-1425 doi: https://doi.org/10.1016/j.saa.2022.120943

Doherty, S. ORCID: https://orcid.org/0000-0003-1103-8090, Knight, J. G., Alharbi, H. Y., Paterson, R., Wills, C., Dixon, C., Šiller, L., Chamberlain, T. W., Griffiths, A., Collins, S. M., Wu, K., Simmons, M. D., Bourne, R. A., Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X and Seymour, J. (2022) Efficient hydrolytic hydrogen evolution from sodium borohydride catalyzed by polymer immobilized ionic liquid‐stabilized platinum nanoparticles. ChemCatChem, 14 (4). e202101752. ISSN 1867-3899 doi: https://doi.org/10.1002/cctc.202101752

de Mello, L. R., Carrascosa, V., Rebelato, E., Juliano, M. A., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Castelletto, V. ORCID: https://orcid.org/0000-0002-3705-0162, Vassiliades, S. V. ORCID: https://orcid.org/0000-0002-4328-9284, Alves, W. A. ORCID: https://orcid.org/0000-0002-8394-2751, Nakaie, C. R. and da Silva, E. R. ORCID: https://orcid.org/0000-0001-5876-2276 (2022) Nanostructure formation and cell spheroid morphogenesis of a peptide supramolecular hydrogel. Langmuir, 38 (11). pp. 3434-3445. ISSN 0743-7463 doi: https://doi.org/10.1021/acs.langmuir.1c03215

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Freer, R., Ekren, D., Ghosh, T., Biswas, K., Qiu, P., Wan, S., Chen, L., Han, S., Fu, C., Zhu, T., Shawon, A. K. M. A., Zevalkink, A., Imasato, K., Snyder, G. J., Ozen, M., Saglik, K., Aydemir, U., Cardoso-Gil, R., Svanidze, E., Funahashi, R., Powell, A. V., Mukherjee, S., Tippireddy, S., Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262, Gascoin, F., Kyratsi, T., Sauerschnig, P. and Mori, T. (2022) Key properties of inorganic thermoelectric materials – tables (version 1). Journal of Physics: Energy, 4 (2). 022002. ISSN 2515-7655 doi: https://doi.org/10.1088/2515-7655/ac49dc

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Gavriel, A. (2022) Self-immolative entities for the enhanced disclosure of electrophilic species. PhD thesis, University of Reading. doi: https://doi.org/10.48683/1926.00117013

Gavriel, A. G., Sambrook, M. R., Russell, A. T. and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2022) Recent advances in self-immolative linkers and their applications in polymeric reporting systems. Polymer Chemistry, 13 (22). pp. 3188-3269. ISSN 1759-9954 doi: https://doi.org/10.1039/D2PY00414C

Gerbelli, B. B., Filho, P. L. O., Cortez, B., Sodré, P. T., Coutinho-Neto, M. D., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Seitsonen, J. and Alves, W. A. (2022) Interaction between glyphosate pesticide and amphiphilic peptides for colorimetric analysis. Nanoscale Advances, 4 (17). pp. 3592-3599. ISSN 2516-0230 doi: https://doi.org/10.1039/D2NA00345G

Gousseva, E., Midgley, S. D., Seymour, J. M., Seidel, R. ORCID: https://orcid.org/0000-0003-2613-4106, Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 and Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X (2022) Understanding X-ray photoelectron spectra of ionic liquids: experiments and simulations of 1-butyl-3-methylimidazolium thiocyanate. Journal of Physical Chemistry B, 126 (49). pp. 10500-10509. ISSN 1520-6106 doi: https://doi.org/10.1021/acs.jpcb.2c06372

Grover, S. (2022) First-principles modelling of functional perovskites. PhD thesis, University of Reading. doi: https://doi.org/10.48683/1926.00113103

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Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2022) Diffuse scattering from lamellar structures. Soft Matter, 18 (4). pp. 711-721. ISSN 1744-683X doi: https://doi.org/10.1039/D1SM01758F

Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2022) Peptides for vaccine development. ACS Applied Bio Materials, 5 (3). pp. 905-944. ISSN 2576-6422 doi: https://doi.org/10.1021/acsabm.1c01238

Hu, Y. X., Deng, Q., Ou, Y.-P., Yang, X., Zhang, J., Garrett, E. K. ORCID: https://orcid.org/0000-0002-5360-7645, Zhu, J. ORCID: https://orcid.org/0000-0002-2099-3156, Liu, S. H. ORCID: https://orcid.org/0000-0002-0784-6418 and Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360 (2022) A conjugated diosma-octacyclic complex and its mixed-valence singly reduced state. Inorganic Chemistry Frontiers, 9 (22). pp. 5893-5902. ISSN 2052-1553 doi: https://doi.org/10.1039/d2qi01523d

Hyder, M., O'Donnell, A. D., Chippindale, A. M. ORCID: https://orcid.org/0000-0002-5918-8701, German, I. M., Harries, J. L., Shebanova, O., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2022) Tailoring viscoelastic properties of dynamic supramolecular poly(butadiene)-based elastomers. Materials Today Chemistry, 26. 101008. ISSN 2468-5194 doi: https://doi.org/10.1016/j.mtchem.2022.101008

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Keane, P. M. ORCID: https://orcid.org/0000-0003-2828-8512, Zehe, C. ORCID: https://orcid.org/0000-0002-3213-5669, Poynton, F. E., Bright, S. A., Estayalo-Adrián, S. ORCID: https://orcid.org/0000-0002-2896-7059, Devereux, S. J., Donaldson, P. M. ORCID: https://orcid.org/0000-0002-0305-9142, Sazanovich, I. V. ORCID: https://orcid.org/0000-0002-8000-7645, Towrie, M., Botchway, S. W., Cardin, C. J. ORCID: https://orcid.org/0000-0002-2556-9995, Williams, D. C., Gunnlaugsson, T. ORCID: https://orcid.org/0000-0003-4814-6853, Long, C. ORCID: https://orcid.org/0000-0002-9484-8744, Kelly, J. M. ORCID: https://orcid.org/0000-0002-3706-1777 and Quinn, S. J. ORCID: https://orcid.org/0000-0002-7773-8842 (2022) Time-resolved infra-red studies of photo-excited porphyrins in the presence of nucleic acids and in HeLa tumour cells: insights into binding site and electron transfer dynamics. Physical Chemistry Chemical Physics, 24 (44). pp. 27524-27531. ISSN 1463-9076 doi: https://doi.org/10.1039/d2cp04604k

Knight, K. S., Gibbs, A. S., Bull, C. L., Powell, A. V., Funnell, N. P. and Ridley, C. J. (2022) Low-intermediate-temperature, high-pressure thermoelastic and crystallographic properties of thermoelectric clausthalite (PbSe-I). Materials Advances, 3 (4). pp. 2077-2088. ISSN ISSN 2633-5409 doi: https://doi.org/10.1039/D1MA01093J

Krenkel, H., Brown, J., Richardson, K., Hoyes, E., Morris, M. and Cramer, R. ORCID: https://orcid.org/0000-0002-8037-2511 (2022) Ultrahigh-throughput sample analysis using liquid atmospheric pressure matrix-assisted laser desorption/ionization mass spectrometry. Analytical Chemistry, 94 (10). pp. 4141-4145. ISSN 0003-2700 doi: https://doi.org/10.1021/acs.analchem.1c05614

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Large, A. I., Bennett, R. A. ORCID: https://orcid.org/0000-0001-6266-3510, Eralp-Erden, T. and Held, G. (2022) In situ surface analysis of palladium-platinum alloys in methane oxidation conditions. Faraday Discussions, 236. pp. 157-177. ISSN 1364-5498 doi: https://doi.org/10.1039/D1FD00113B

Liu, W., Das, P. J., Colquhoun, H. M. and Stoddart, J. F. (2022) Whither second-sphere coordination? CCS Chemistry, 4 (3). pp. 755-784. ISSN 2096-5745 doi: https://doi.org/10.31635/ccschem.021.202101286

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Maji, K., Lemoine, P., Renaud, A., Zhang, B., Zhou, X., Carnevali, V., Candolfi, C., Raveau, B., Al Orabi, R. A. R., Fornari, M., Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262, Pasturel, M., Prestipino, C. and Guilmeau, E. (2022) A tunable structural family with ultralow thermal conductivity: copper deficient Cu1-x□xPb1-xBi1+xS3. Journal of the American Chemical Society, 144 (4). pp. 1846-1860. ISSN 0002-7863 doi: https://doi.org/10.1021/jacs.1c11998

McQuaid, K. T. ORCID: https://orcid.org/0000-0002-3222-5584, Pipier, A., Cardin, C. J. ORCID: https://orcid.org/0000-0002-2556-9995 and Monchaud, D. ORCID: https://orcid.org/0000-0002-3056-9295 (2022) Interactions of small molecules with DNA junctions. Nucleic Acids Research, 50 (22). pp. 12636-12656. ISSN 1362-4962 doi: https://doi.org/10.1093/nar/gkac1043

McQuaid, K. T. ORCID: https://orcid.org/0000-0002-3222-5584, Takahashi, S., Baumgaertner, L., Cardin, D. J., Paterson, N. G., Hall, J. P. ORCID: https://orcid.org/0000-0003-3716-4378, Sugimoto, N. and Cardin, C. J. ORCID: https://orcid.org/0000-0002-2556-9995 (2022) Ruthenium polypyridyl complex bound to a unimolecular chair-form G-quadruplex. Journal of the American Chemical Society, 144 (13). pp. 5956-5964. ISSN 0002-7863 doi: https://doi.org/10.1021/jacs.2c00178

Menendez-Proupin, E., Grover, S., Montero-Alejo, A. L., Midgley, S. D., Butler, K. T. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2022) Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study. Journal of Materials Chemistry A, 10 (17). pp. 9592-9603. ISSN 0959-9428 doi: https://doi.org/10.1039/D1TA10860C

Midgley, S. D., Fleitmann, D. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2022) Bromate incorporation in calcite and aragonite. Geochimica Et Cosmochimica Acta, 324. pp. 17-25. ISSN 0016-7037 doi: https://doi.org/10.1016/j.gca.2022.02.028

Mondal, B., Gupta, V. K., Hansda, B., Bhoumik, A., Mondal, T., Majumder, H. K., Edwards-Gayle, C. J. C., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Jaisankar, P. and Banerjee, A. (2022) Amino acid containing amphiphilic hydrogelators with antibacterial and antiparasitic activities. Soft Matter, 18 (37). pp. 7201-7216. ISSN 1744-683X doi: https://doi.org/10.1039/D2SM00562J

Mukherjee, S., Powell, A. V., Voneshen, D. J. and Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262 (2022) Talnakhite: a potential n-type thermoelectric sulphide with low thermal conductivity. Journal of Solid State Chemistry, 314. 123425. ISSN 0022-4596 doi: https://doi.org/10.1016/j.jssc.2022.123425

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O'Donnell, A. D., Salimi, S., Hart, L. R., Babra, T. S., Greenland, B. W. and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2022) Applications of supramolecular polymer networks. Reactive and Functional Polymers, 172. 105209. ISSN 1381-5148 doi: https://doi.org/10.1016/j.reactfunctpolym.2022.105209

Orton, G. R. F., Ghosh, S., Alker, L., Sarker, J. C., Pugh, D., Richmond, M. G., Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360 and Hogarth, G. (2022) Biomimics of [FeFe]-hydrogenases incorporating redox-active ligands: synthesis, redox properties and spectroelectrochemistry of diiron-dithiolate complexes with ferrocenyl-diphosphines as Fe4S4 surrogates. Dalton Transactions, 51 (25). pp. 9748-9769. ISSN 1364-5447 doi: https://doi.org/10.1039/d2dt00419d

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Plata, J. J., Posligua, V., Marquez, A. M., Sanz, J. F. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2022) Charting the lattice thermal conductivities of I-III-VI2 chalcopyrite semiconductors. Chemistry of Materials, 34 (6). pp. 2833-2841. ISSN 1520-5002 doi: https://doi.org/10.1021/acs.chemmater.2c00336

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Reeves, S. J., Davis, F. J. ORCID: https://orcid.org/0000-0003-0462-872X and Mitchell, G. R. (2022) Ferronematic liquid crystal polymers and elastomers. In: MATERIALS 2022. doi: https://doi.org/10.3390/materproc2022008135

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Salimi, S. (2022) Property enhancement of supramolecular polymers for 3D printing. PhD thesis, University of Reading. doi: https://doi.org/10.48683/1926.00116541

Sanchez-Palencia, P., Hamad, S., Palacios, P., Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 and Butler, K. T. (2022) Spinel nitride solid solutions: charting properties in the configurational space with explainable machine learning. Digital Discovery, 1 (5). pp. 665-678. ISSN 2635-098X doi: https://doi.org/10.1039/D2DD00038E

Seymour, J. M. (2022) An investigation of the electronic structure of ions in the liquid phase using x-ray spectroscopic techniques. PhD thesis, University of Reading. doi: https://doi.org/10.48683/1926.00113104

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