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Identifying Novel Inhibitors for Hepatic Organic Anion Transporting Polypeptides by Machine Learning-Based Virtual Screening.
Tuerkova A, Bongers BJ, Norinder U, Ungvári O, Székely V, Tarnovskiy A, Szakács G, Özvegy-Laczka C, van Westen GJP, Zdrazil B. Tuerkova A, et al. Among authors: norinder u. J Chem Inf Model. 2022 Dec 26;62(24):6323-6335. doi: 10.1021/acs.jcim.1c01460. Epub 2022 Mar 11. J Chem Inf Model. 2022. PMID: 35274943 Free PMC article. Review.
Choosing feature selection and learning algorithms in QSAR.
Eklund M, Norinder U, Boyer S, Carlsson L. Eklund M, et al. Among authors: norinder u. J Chem Inf Model. 2014 Mar 24;54(3):837-43. doi: 10.1021/ci400573c. Epub 2014 Mar 5. J Chem Inf Model. 2014. PMID: 24460242
Deep Learning-Based Conformal Prediction of Toxicity.
Zhang J, Norinder U, Svensson F. Zhang J, et al. Among authors: norinder u. J Chem Inf Model. 2021 Jun 28;61(6):2648-2657. doi: 10.1021/acs.jcim.1c00208. Epub 2021 May 27. J Chem Inf Model. 2021. PMID: 34043352
Integrate mechanistic evidence from new approach methodologies (NAMs) into a read-across assessment to characterise trends in shared mode of action.
Escher SE, Aguayo-Orozco A, Benfenati E, Bitsch A, Braunbeck T, Brotzmann K, Bois F, van der Burg B, Castel J, Exner T, Gadaleta D, Gardner I, Goldmann D, Hatley O, Golbamaki N, Graepel R, Jennings P, Limonciel A, Long A, Maclennan R, Mombelli E, Norinder U, Jain S, Capinha LS, Taboureau OT, Tolosa L, Vrijenhoek NG, van Vugt-Lussenburg BMA, Walker P, van de Water B, Wehr M, White A, Zdrazil B, Fisher C. Escher SE, et al. Among authors: norinder u. Toxicol In Vitro. 2022 Mar;79:105269. doi: 10.1016/j.tiv.2021.105269. Epub 2021 Oct 29. Toxicol In Vitro. 2022. PMID: 34757180 Free article.
111 results