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Publication Date2024-01
Computational prediction of complex cationic rearrangement outcomes
Klucznik, Tomasz; Syntrivanis, Leonidas-Dimitrios; Baś, Sebastian, et al
Nature, v.625, pp.508 - 515
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Publication Date2022-04
Computer-designed repurposing of chemical wastes into drugs
Wołos, Agnieszka; Koszelewski, Dominik; Roszak, Rafał, et al
Nature, v.604, no.7907, pp.668 - 676
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Publication Date2023-01
Network search algorithms and scoring functions for advanced-level computerized synthesis planning
Bartosz A. Grzybowski; Badowski, Tomasz; Molga, Karol, et al
Wiley Interdisciplinary Reviews: Computational Molecular Science, v.13, no.1