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Constrained Bayesian optimization for automatic chemical design using variational autoencoders

Journal: Chemical Science

Published: 2020-01-02

DOI: 10.1039/c9sc04026a

Affiliations: 4

Authors: 2

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Institutions Share
Cavendish Laboratory, University of Cambridge, United Kingdom (UK) 0.50
Department of Engineering, University of Cambridge, United Kingdom (UK) 0.17
Alan Turing Institute, United Kingdom (UK) 0.17
Microsoft Research Ltd., United Kingdom (UK) 0.17