Convolutional networks on graphs for learning molecular fingerprints

David Duvenaud, Dougal Maclaurin, Jorge Aguilera-Iparraguirre, Rafael Gómez-Bombarelli, Timothy Hirzel, Alán Aspuru-Guzik, Ryan P. Adams

Research output: Contribution to journalConference articlepeer-review

1308 Scopus citations

Fingerprint

Dive into the research topics of 'Convolutional networks on graphs for learning molecular fingerprints'. Together they form a unique fingerprint.

Engineering & Materials Science