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"QSAR Modeling Based on Conformation Ensembles Using a Multi-Instance ..."

Dmitry V. Zankov et al. (2021)

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DOI: 10.1021/ACS.JCIM.1C00692

access: closed

type: Journal Article

metadata version: 2021-12-15

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Dmitry V. Zankov, Mariia Matveieva, Aleksandra V. Nikonenko, Ramil I. Nugmanov, Igor I. Baskin, Alexandre Varnek, Pavel G. Polishchuk, Timur I. Madzhidov:
QSAR Modeling Based on Conformation Ensembles Using a Multi-Instance Learning Approach. J. Chem. Inf. Model. 61(10): 4913-4923 (2021)

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