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2018 4
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Dual Use of Artificial Intelligence-powered Drug Discovery.
Urbina F, Lentzos F, Invernizzi C, Ekins S. Urbina F, et al. Nat Mach Intell. 2022 Mar;4(3):189-191. doi: 10.1038/s42256-022-00465-9. Epub 2022 Mar 7. Nat Mach Intell. 2022. PMID: 36211133 Free PMC article.
AI in drug discovery: A wake-up call.
Urbina F, Lentzos F, Invernizzi C, Ekins S. Urbina F, et al. Drug Discov Today. 2023 Jan;28(1):103410. doi: 10.1016/j.drudis.2022.103410. Epub 2022 Oct 18. Drug Discov Today. 2023. PMID: 36270472 Free PMC article.
Mycobacterium abscessus drug discovery using machine learning.
Schmalstig AA, Zorn KM, Murcia S, Robinson A, Savina S, Komarova E, Makarov V, Braunstein M, Ekins S. Schmalstig AA, et al. Tuberculosis (Edinb). 2022 Jan;132:102168. doi: 10.1016/j.tube.2022.102168. Epub 2022 Jan 20. Tuberculosis (Edinb). 2022. PMID: 35077930 Free PMC article.
Transparency in Decision Modelling: What, Why, Who and How?
Sampson CJ, Arnold R, Bryan S, Clarke P, Ekins S, Hatswell A, Hawkins N, Langham S, Marshall D, Sadatsafavi M, Sullivan W, Wilson ECF, Wrightson T. Sampson CJ, et al. Pharmacoeconomics. 2019 Nov;37(11):1355-1369. doi: 10.1007/s40273-019-00819-z. Pharmacoeconomics. 2019. PMID: 31240636 Free PMC article. Review.
Multiple approaches to repurposing drugs for neuroblastoma.
Rank L, Puhl AC, Havener TM, Anderson E, Foil DH, Zorn KM, Monakhova N, Riabova O, Hickey AJ, Makarov V, Ekins S. Rank L, et al. Bioorg Med Chem. 2022 Nov 1;73:117043. doi: 10.1016/j.bmc.2022.117043. Epub 2022 Oct 4. Bioorg Med Chem. 2022. PMID: 36208544 Free PMC article.
In silico ADME/tox comes of age: twenty years later.
Ekins S, Lane TR, Urbina F, Puhl AC. Ekins S, et al. Xenobiotica. 2023 Aug 8:1-7. doi: 10.1080/00498254.2023.2245049. Online ahead of print. Xenobiotica. 2023. PMID: 37539466 Review.
A teachable moment for dual-use.
Urbina F, Lentzos F, Invernizzi C, Ekins S. Urbina F, et al. Nat Mach Intell. 2022 Jul;4(7):607. doi: 10.1038/s42256-022-00511-6. Epub 2022 Jul 12. Nat Mach Intell. 2022. PMID: 36393980 Free PMC article. No abstract available.
Combining DELs and machine learning for toxicology prediction.
Blay V, Li X, Gerlach J, Urbina F, Ekins S. Blay V, et al. Drug Discov Today. 2022 Nov;27(11):103351. doi: 10.1016/j.drudis.2022.103351. Epub 2022 Sep 9. Drug Discov Today. 2022. PMID: 36096360 Free PMC article. Review.
84 results