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"Automatic chemical design using a data-driven continuous representation of ..."
Rafael Gómez-Bombarelli et al. (2016)
- Rafael Gómez-Bombarelli, David Duvenaud, José Miguel Hernández-Lobato, Jorge Aguilera-Iparraguirre, Timothy D. Hirzel, Ryan P. Adams, Alán Aspuru-Guzik:
Automatic chemical design using a data-driven continuous representation of molecules. CoRR abs/1610.02415 (2016)
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