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Pyzer-Knapp, Edward O ORCID: 0000-0002-8232-8282, Chen, Linjiang, Day, Graeme M and Cooper, Andrew I ORCID: 0000-0003-0201-1021 (2021) Accelerating computational discovery of porous solids through improved navigation of energy-structure-function maps. SCIENCE ADVANCES, 7 (33). eabi4763-.

Zhu, Qiang, Johal, Jay, Widdowson, Daniel E ORCID: 0000-0002-5958-0703, Pang, Zhongfu, Li, Boyu, Kane, Christopher M, Kurlin, Vitaliy ORCID: 0000-0001-5328-5351, Day, Graeme M, Little, Marc A and Cooper, Andrew I ORCID: 0000-0003-0201-1021 (2022) Analogy Powered by Prediction and Structural Invariants: Computationally Led Discovery of a Mesoporous Hydrogen-Bonded Organic Cage Crystal. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 144 (22). pp. 9893-9901.

McMahon, David P, Stephenson, Andrew, Chong, Samantha Y ORCID: 0000-0002-3095-875X, Little, Marc A, Jones, James TA, Cooper, Andrew I ORCID: 0000-0003-0201-1021 and Day, Graeme M (2018) Computational modelling of solvent effects in a prolific solvatomorphic porous organic cage. FARADAY DISCUSSIONS, 211. pp. 383-399.

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Slater, Anna G ORCID: 0000-0002-1435-4331, Reiss, Paul S, Pulido, Angeles, Little, Marc A, Holden, Daniel L, Chen, Linjiang, Chong, Samantha Y ORCID: 0000-0002-3095-875X, Alston, Ben M ORCID: 0000-0001-8255-7950, Clowes, Rob, Haranczyk, Maciej et al (show 4 more authors) , Briggs, Michael E ORCID: 0000-0003-1474-1267, Hasell, Tom ORCID: 0000-0003-4736-0604, Day, Graeme M and Cooper, Andrew I ORCID: 0000-0003-0201-1021 (2017) Computationally-Guided Synthetic Control over Pore Size in Isostructural Porous Organic Cages. ACS CENTRAL SCIENCE, 3 (7). pp. 734-742.

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Hasell, Tom ORCID: 0000-0003-4736-0604, Culshaw, Jamie L, Chong, Sam ORCID: 0000-0002-3095-875X, Schmidtmann, Marc, Little, Marc, Jelfs, Kim E, Pyzer-Knapp, Edward O ORCID: 0000-0002-8232-8282, Shepherd, Hilary, Adams, Dave, Day, Graeme M et al (show 1 more authors) and Cooper, Andy ORCID: 0000-0003-0201-1021 (2014) Controlling the Crystallization of Porous Organic Cages: Molecular Analogs of Isoreticular Frameworks Using Shape-Specific Directing Solvents. Journal of the American Chemical Society, 136 (4). pp. 1438-1448.

Torda, Miloslav, Goulermas, John Y, Kurlin, Vitaliy ORCID: 0000-0001-5328-5351 and Day, Graeme M (2022) Densest plane group packings of regular polygons. [Preprint]

Torda, Miloslav, Goulermas, John Y, Kurlin, Vitaliy ORCID: 0000-0001-5328-5351 and Day, Graeme M (2022) Densest plane group packings of regular polygons. PHYSICAL REVIEW E, 106 (5). 054603-.

Zhao, Chengxi, Chen, Linjiang, Che, Yu ORCID: 0000-0002-8589-6795, Pang, Zhongfu, Wu, Xiaofeng ORCID: 0000-0001-5549-8836, Lu, Yunxiang, Liu, Honglai, Day, Graeme M and Cooper, Andrew I ORCID: 0000-0003-0201-1021 (2021) Digital navigation of energy-structure-function maps for hydrogen-bonded porous molecular crystals. NATURE COMMUNICATIONS, 12 (1). 817-.

Day, Graeme M and Cooper, Andrew I ORCID: 0000-0003-0201-1021 (2018) Energy-Structure-Function Maps: Cartography for Materials Discovery. ADVANCED MATERIALS, 30 (37). e1704944-.

Cui, Peng, Svensson Grape, Erik, Spackman, Peter R, Wu, Yue ORCID: 0000-0003-2874-8267, Clowes, Rob, Day, Graeme M, Inge, A Ken, Little, Marc A and Cooper, Andrew I ORCID: 0000-0003-0201-1021 (2020) An Expandable Hydrogen-Bonded Organic Framework Characterized by Three-Dimensional Electron Diffraction. Journal of the American Chemical Society, 142 (29). pp. 12743-12750.

Shields, Caitlin E ORCID: 0000-0001-6335-7507, Wang, Xue, Fellowes, Thomas ORCID: 0000-0002-6389-6049, Clowes, Rob, Chen, Linjiang ORCID: 0000-0002-0382-5863, Day, Graeme M ORCID: 0000-0001-8396-2771, Slater, Anna G ORCID: 0000-0002-1435-4331, Ward, John W ORCID: 0000-0001-7186-6416, Little, Marc A ORCID: 0000-0002-1994-0591 and Cooper, Andrew I ORCID: 0000-0003-0201-1021 (2023) Experimental Confirmation of a Predicted Porous Hydrogen‐Bonded Organic Framework. Angewandte Chemie, 135 (34).

Greenaway, Rebecca L ORCID: 0000-0003-1541-4399, Santolini, Valentina, Pulido, Angeles, Little, Marc A, Alston, Ben M ORCID: 0000-0001-8255-7950, Briggs, Michael E, Day, Graeme M, Cooper, Andrew I and Jelfs, Kim E (2019) From Concept to Crystals via Prediction: Multi-Component Organic Cage Pots by Social Self-Sorting. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 58 (45). 16275 - 16281.

Greenaway, Rebecca L ORCID: 0000-0003-1541-4399, Santolini, Valentina, Pulido, Angeles, Little, Marc A, Alston, Ben M ORCID: 0000-0001-8255-7950, Briggs, Michael E, Day, Graeme M, Cooper, Andrew I ORCID: 0000-0003-0201-1021 and Jelfs, Kim E (2019) From Concept to Crystals via Prediction: Multi-Component Organic Cage Pots by Social Self-Sorting. Angewandte Chemie International Edition, 58 (45). pp. 16275-16281.

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He, Donglin ORCID: 0000-0002-5512-8162, Zhao, Chengxi, Chen, Linjiang, Little, Marc A, Chong, Samantha Y ORCID: 0000-0002-3095-875X, Clowes, Rob, McKie, Katherine, Roper, Mark G, Day, Graeme M, Liu, Ming ORCID: 0000-0003-0008-1480 et al (show 1 more authors) and Cooper, Andrew I (2021) Inherent Ethyl Acetate Selectivity in a Trianglimine Molecular Solid. CHEMISTRY-A EUROPEAN JOURNAL, 27 (41). pp. 10589-10594.

Cui, Peng, McMahon, David P, Spackman, Peter R, Alston, Ben M ORCID: 0000-0001-8255-7950, Little, Marc A, Day, Graeme M and Cooper, Andrew I ORCID: 0000-0003-0201-1021 (2019) Mining predicted crystal structure landscapes with high throughput crystallisation: old molecules, new insights. CHEMICAL SCIENCE, 10 (43). pp. 9988-9997.

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Aitchison, Catherine ORCID: 0000-0003-1437-8314, Kane, Christopher, McMahon, David P, Spackman, Peter, Wang, xiaoyan, Wilbraham, Liam, Pulido, Angeles, Chen, linjiang, Clowes, Rob, Little, Marc et al (show 4 more authors) , Zwijnenbur, Martijn A, Sprick, Reiner, Day, Graeme M and Cooper, Andrew ORCID: 0000-0003-0201-1021 (2020) Photocatalytic Proton Reduction by a Computationally Identified, Molecular Hydrogen-Bonded Framework. Journal of Materials Chemistry A, 2020 (15). pp. 7158-7170.

O'Shaughnessy, Megan, Spackman, Peter R, Little, Marc A, Catalano, Luca, James, Alex, Day, Graeme M and Cooper, Andrew I ORCID: 0000-0003-0201-1021 (2022) Targeted design of porous materials without strong, directional interactions. CHEMICAL COMMUNICATIONS, 58 (95). pp. 13254-13257.

Jelfs, Kim E, Eden, Edward GB, Culshaw, Jamie L, Shakespeare, Stephen, Pyzer-Knapp, Edward O, Thompson, Hugh PG, Bacsa, John, Day, Graeme M, Adams, Dave J and Cooper, Andrew I ORCID: 0000-0003-0201-1021 (2013) <i>In silico</i> Design of Supramolecules from Their Precursors: Odd-Even Effects in Cage-Forming Reactions. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 135 (25). pp. 9307-9310.