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ChemBO: Bayesian Optimization of Small Organic Molecules with Synthesizable Recommendations.

, , , , , , and . AISTATS, volume 108 of Proceedings of Machine Learning Research, page 3393-3403. PMLR, (2020)

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Minimizing FLOPs to Learn Efficient Sparse Representations., , , , , and . ICLR, OpenReview.net, (2020)Myopic Bayesian Design of Experiments via Posterior Sampling and Probabilistic Programming., , , , , and . CoRR, (2018)Myopic Posterior Sampling for Adaptive Goal Oriented Design of Experiments., , , , , and . ICML, volume 97 of Proceedings of Machine Learning Research, page 3222-3232. PMLR, (2019)ChemBO: Bayesian Optimization of Small Organic Molecules with Synthesizable Recommendations., , , , , , and . AISTATS, volume 108 of Proceedings of Machine Learning Research, page 3393-3403. PMLR, (2020)On the Estimation of alpha-Divergences., and . AISTATS, volume 15 of JMLR Proceedings, page 609-617. JMLR.org, (2011)Bayesian Nonparametric Kernel-Learning., , , , , and . AISTATS, volume 51 of JMLR Workshop and Conference Proceedings, page 1078-1086. JMLR.org, (2016)High Dimensional Bayesian Optimisation and Bandits via Additive Models., , and . ICML, volume 37 of JMLR Workshop and Conference Proceedings, page 295-304. JMLR.org, (2015)Multi-fidelity Bayesian Optimisation with Continuous Approximations., , , and . ICML, volume 70 of Proceedings of Machine Learning Research, page 1799-1808. PMLR, (2017)Independent subspace analysis using geodesic spanning trees., and . ICML, volume 119 of ACM International Conference Proceeding Series, page 673-680. ACM, (2005)Undercomplete Blind Subspace Deconvolution Via Linear Prediction., , and . ECML, volume 4701 of Lecture Notes in Computer Science, page 740-747. Springer, (2007)