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RMG Database for Chemical Property Prediction.
Johnson MS, Dong X, Grinberg Dana A, Chung Y, Farina D Jr, Gillis RJ, Liu M, Yee NW, Blondal K, Mazeau E, Grambow CA, Payne AM, Spiekermann KA, Pang HW, Goldsmith CF, West RH, Green WH. Johnson MS, et al. Among authors: chung y. J Chem Inf Model. 2022 Oct 24;62(20):4906-4915. doi: 10.1021/acs.jcim.2c00965. Epub 2022 Oct 12. J Chem Inf Model. 2022. PMID: 36222558
Chemprop: A Machine Learning Package for Chemical Property Prediction.
Heid E, Greenman KP, Chung Y, Li SC, Graff DE, Vermeire FH, Wu H, Green WH, McGill CJ. Heid E, et al. Among authors: chung y. J Chem Inf Model. 2024 Jan 8;64(1):9-17. doi: 10.1021/acs.jcim.3c01250. Epub 2023 Dec 26. J Chem Inf Model. 2024. PMID: 38147829 Free PMC article.
7,319 results