Ab Initio Machine Learning in Chemical Compound Space

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Authors: Bing Huang, O. Anatole von Lilienfeld

Journal title: Chemical Reviews

Journal number: 121/16

Journal publisher: American Chemical Society

Published year: 2021

Published pages: 10001-10036

DOI identifier: 10.1021/acs.chemrev.0c01303

ISSN: 0009-2665