"Molecular graph convolutions: moving beyond fingerprints."

Steven Kearnes et al. (2016)

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DOI: 10.1007/S10822-016-9938-8

access: closed

type: Journal Article

metadata version: 2022-04-20

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  - https://dblp.org/rec/journals/jcamd/KearnesMBPR16
Steven Kearnes, Kevin McCloskey, Marc Berndl, Vijay S. Pande, Patrick Riley:
Molecular graph convolutions: moving beyond fingerprints. J. Comput. Aided Mol. Des. 30(8): 595-608 (2016)

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