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Learning More, with Less by Benjamín Sánchez-Lengeling, Alán Aspuru-Guzik
Published 2017-04-01
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Automatic Chemical Design Using a Data-Driven Continuous Representation of Molecules by Rafael Gómez-Bombarelli, Jennifer N. Wei, David Duvenaud, José Miguel Hernández-Lobato, Benjamín Sánchez-Lengeling, Dennis Sheberla, Jorge Aguilera-Iparraguirre, Timothy D. Hirzel, Ryan P. Adams, Alán Aspuru-Guzik
Published 2018-01-01
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Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models by Daniil Polykovskiy, Alexander Zhebrak, Benjamin Sanchez-Lengeling, Sergey Golovanov, Oktai Tatanov, Stanislav Belyaev, Rauf Kurbanov, Aleksey Artamonov, Vladimir Aladinskiy, Mark Veselov, Artur Kadurin, Simon Johansson, Hongming Chen, Sergey Nikolenko, Sergey Nikolenko, Sergey Nikolenko, Alán Aspuru-Guzik, Alán Aspuru-Guzik, Alán Aspuru-Guzik, Alán Aspuru-Guzik, Alex Zhavoronkov
Published 2020-12-01
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