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Vriza, Aikaterini ORCID: 0000-0002-5663-8703, Sovago, Ioana, Widdowson, Daniel, Kurlin, Vitaliy, Wood, Peter A ORCID: 0000-0002-5239-2160 and Dyer, Matthew S ORCID: 0000-0002-4923-3003
(2022)
Molecular set transformer: attending to the co-crystals in the Cambridge structural database.
Digital Discovery, 1 (6).
pp. 834-850.
Vriza, Aikaterini ORCID: 0000-0002-5663-8703, Canaj, Angelos B ORCID: 0000-0002-4944-7909, Vismara, Rebecca ORCID: 0000-0001-9474-7671, Kershaw Cook, Laurence J, Manning, Troy D ORCID: 0000-0002-7624-4306, Gaultois, Michael W ORCID: 0000-0003-2172-2507, Wood, Peter A, Kurlin, Vitaliy ORCID: 0000-0001-5328-5351, Berry, Neil ORCID: 0000-0003-1928-0738, Dyer, Matthew S ORCID: 0000-0002-4923-3003 et al (show 1 more authors)
(2021)
One class classification as a practical approach for accelerating π–π co-crystal discovery.
Chemical Science, 12 (5).
pp. 1702-1719.