Neuraldecipher – reverse-engineering extended-connectivity fingerprints (ECFPs) to their molecular structures

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Authors: Tuan Le, Robin Winter, Frank Noé, Djork-Arné Clevert

Journal title: Chemical Science

Journal number: 11/38

Journal publisher: Royal Society of Chemistry

Published year: 2020

Published pages: 10378-10389

DOI identifier: 10.1039/d0sc03115a

ISSN: 2041-6520