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Yan, Yong ORCID: 0000-0002-7926-3959, Carrington, Elliot J, Petuya, Remi ORCID: 0000-0002-3118-6966, Whitehead, George FS, Verma, Ajay ORCID: 0000-0001-8085-7351, Hylton, Rebecca K, Tang, Chiu C, Berry, Neil G ORCID: 0000-0003-1928-0738, Darling, George R ORCID: 0000-0001-9329-9993, Dyer, Matthew S ORCID: 0000-0002-4923-3003 et al (show 3 more authors) , Antypov, Dmytro ORCID: 0000-0003-1893-7785, Katsoulidis, Alexandros P ORCID: 0000-0003-0860-7440 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2020) Amino Acid Residues Determine the Response of Flexible Metal-Organic Frameworks to Guests. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 142 (35). pp. 14903-14913.

Carrington, Elliot J ORCID: 0000-0001-8855-809X, Petuya, Remi ORCID: 0000-0002-3118-6966, Hylton, Rebecca K, Yan, Yong, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Darling, George R ORCID: 0000-0001-9329-9993, Dyer, Matthew S ORCID: 0000-0002-4923-3003, Berry, Neil G ORCID: 0000-0003-1928-0738, Katsoulidis, Alexandros P ORCID: 0000-0003-0860-7440 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2019) The Anisotropic Responses of a Flexible Metal-Organic Framework Constructed from Asymmetric Flexible Linkers and Heptanuclear Zinc Carboxylate Secondary Building Units. CRYSTAL GROWTH & DESIGN, 19 (10). pp. 5604-5618.

Sharp, Paul M, Dyer, Matthew S ORCID: 0000-0002-4923-3003, Darling, George R ORCID: 0000-0001-9329-9993, Claridge, John B ORCID: 0000-0003-4849-6714 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2020) Chemically directed structure evolution for crystal structure prediction. Physical Chemistry Chemical Physics, 22 (32). pp. 18205-18218.

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Tzitzeklis, Christos A, Gupta, Jyoti K, Dyer, Matthew S ORCID: 0000-0002-4923-3003, Manning, Troy D ORCID: 0000-0002-7624-4306, Pitcher, Michael J ORCID: 0000-0003-2044-6774, Niu, Hongjun J, Savvin, Rstanislav, Alaria, Jonathan ORCID: 0000-0001-5868-0318, Darling, George R ORCID: 0000-0001-9329-9993, Claridge, John B ORCID: 0000-0003-4849-6714 et al (show 1 more authors) and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2018) Computational Prediction and Experimental Realization of p-Type Carriers in the Wide-Band-Gap Oxide SrZn_1-<i>x</i>Li<i>_x</i>O₂. INORGANIC CHEMISTRY, 57 (19). pp. 11874-11883.

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Dyer, Matthew S ORCID: 0000-0002-4923-3003, Collins, Christopher ORCID: 0000-0002-0101-4426, Hodgeman, Darren, Chater, Philip A, Demont, Antoine, Romani, Simon, Sayers, Ruth, Thomas, Michael F, Claridge, John B ORCID: 0000-0003-4849-6714, Darling, George R ORCID: 0000-0001-9329-9993 et al (show 1 more authors) and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2013) Computationally Assisted Identification of Functional Inorganic Materials. SCIENCE, 340 (6134). pp. 847-852.

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Collins, Christopher M ORCID: 0000-0002-0101-4426, Daniels, Luke M ORCID: 0000-0002-7077-6125, Gibson, Quinn, Gaultois, Michael W ORCID: 0000-0003-2172-2507, Moran, Michael, Feetham, Richard, Pitcher, Michael J, Dyer, Matthew S ORCID: 0000-0002-4923-3003, Delacotte, Charlene, Zanella, Marco ORCID: 0000-0002-6164-6169 et al (show 9 more authors) , Murray, Claire A, Glodan, Gyorgyi, Perez, Olivier, Pelloquin, Denis, Manning, Troy D ORCID: 0000-0002-7624-4306, Alaria, Jonathan ORCID: 0000-0001-5868-0318, Darling, George R ORCID: 0000-0001-9329-9993, Claridge, John B ORCID: 0000-0003-4849-6714 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2021) Discovery of a Low Thermal Conductivity Oxide Guided by Probe Structure Prediction and Machine Learning. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 60 (30). pp. 16457-16465.

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Collins, Christopher M ORCID: 0000-0002-0101-4426, Daniels, Luke M ORCID: 0000-0002-7077-6125, Gibson, Quinn, Gaultois, Michael W ORCID: 0000-0003-2172-2507, Moran, Michael, Feetham, Richard, Pitcher, Michael J, Dyer, Matthew S, Delacotte, Charlene, Zanella, Marco et al (show 9 more authors) , Murray, Claire A, Glodan, Gyorgyi, Pérez, Olivier, Pelloquin, Denis, Manning, Troy D, Alaria, Jonathan, Darling, George R, Claridge, John B and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2021) Discovery of a Low Thermal Conductivity Oxide Guided by Probe Structure Prediction and Machine Learning. Angewandte Chemie, 133 (30). pp. 16593-16601.

Gerrard, Nikki, Mistry, Kallum, Darling, George R ORCID: 0000-0001-9329-9993 and Hodgson, Andrew ORCID: 0000-0001-8677-7467 (2020) Formation of Linear Water Chains on Ni(110). JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 11 (6). pp. 2121-2126.

Lin, Chenfang, Darling, George R ORCID: 0000-0001-9329-9993, Forster, Matthew, McBride, Fiona ORCID: 0000-0003-2985-3173, Massey, Alan and Hodgson, Andrew ORCID: 0000-0001-8677-7467 (2020) Hydration of a 2D Supramolecular Assembly: Bitartrate on Cu(110). JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 142 (32). pp. 13814-13822.

Petuya, Remi ORCID: 0000-0002-3118-6966, Durdy, Samantha, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Gaultois, Michael W ORCID: 0000-0003-2172-2507, Berry, Neil G ORCID: 0000-0003-1928-0738, Darling, George R ORCID: 0000-0001-9329-9993, Katsoulidis, Alexandros P ORCID: 0000-0003-0860-7440, Dyer, Matthew S ORCID: 0000-0002-4923-3003 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2022) Machine-Learning Prediction of Metal-Organic Framework Guest Accessibility from Linker and Metal Chemistry. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 61 (9). e202114573-.

Pétuya, Rémi ORCID: 0000-0002-3118-6966, Durdy, Samantha, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Gaultois, Michael W ORCID: 0000-0003-2172-2507, Berry, Neil G ORCID: 0000-0003-1928-0738, Darling, George R ORCID: 0000-0001-9329-9993, Katsoulidis, Alexandros P ORCID: 0000-0003-0860-7440, Dyer, Matthew S ORCID: 0000-0002-4923-3003 and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2022) Machine‐Learning Prediction of Metal–Organic Framework Guest Accessibility from Linker and Metal Chemistry. Angewandte Chemie, 134 (9).

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Adamson, Duncan ORCID: 0000-0003-3343-2435, Gusev, Vladimir V, Deligkas, Argyrios, Antypov, Dmytro ORCID: 0000-0003-1893-7785, Collins, Chritopher M ORCID: 0000-0002-0101-4426, Krysta, Piotr, Potapov, Igor, Darling, George R ORCID: 0000-0001-9329-9993, Dyer, Matthew S ORCID: 0000-0002-4923-3003, Spirakis, Paul ORCID: 0000-0001-5396-3749 et al (show 1 more authors) and Rosseinsky, Matthew J ORCID: 0000-0002-1910-2483 (2023) Optimality Guarantees for Crystal Structure Prediction. Nature, 619 (7968). 68-+.

Bacsa, John, Hanke, Felix, Hindley, Sarah, Odedra, Rajesh, Darling, George R ORCID: 0000-0001-9329-9993, Jones, Anthony C and Steiner, Alexander ORCID: 0000-0002-4315-6123 (2011) The Solid-State Structures of Dimethylzinc and Diethylzinc. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 50 (49). pp. 11685-11687.

Gerrard, Nikki, Mistry, Kallum, Darling, George R ORCID: 0000-0001-9329-9993 and Hodgson, Andrew ORCID: 0000-0001-8677-7467 (2020) Water Dissociation and Hydroxyl Formation on Ni(110). JOURNAL OF PHYSICAL CHEMISTRY C, 124 (43). pp. 23815-23822.