"Exposing the Limitations of Molecular Machine Learning with Activity Cliffs."

Derek van Tilborg, Alisa Alenicheva, Francesca Grisoni (2022)

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DOI: 10.1021/ACS.JCIM.2C01073

access: open

type: Journal Article

metadata version: 2023-09-30

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  - https://dblp.org/rec/journals/jcisd/TilborgAG22
Derek van Tilborg, Alisa Alenicheva, Francesca Grisoni:
Exposing the Limitations of Molecular Machine Learning with Activity Cliffs. J. Chem. Inf. Model. 62(23): 5938-5951 (2022)

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