"Molecular Similarity-Based Domain Applicability Metric Efficiently ..."

Ruifeng Liu, Anders Wallqvist (2019)

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DOI: 10.1021/ACS.JCIM.8B00597

access: closed

type: Journal Article

metadata version: 2021-06-01

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Ruifeng Liu, Anders Wallqvist:
Molecular Similarity-Based Domain Applicability Metric Efficiently Identifies Out-of-Domain Compounds. J. Chem. Inf. Model. 59(1): 181-189 (2019)

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