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Barking up the right tree: an approach to search over molecule synthesis DAGs

Dec 21, 2020
John Bradshaw, Brooks Paige, Matt J. Kusner, Marwin H. S. Segler, José Miguel Hernández-Lobato

* To appear in Advances in Neural Information Processing Systems 2020 

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A Model to Search for Synthesizable Molecules

Jun 12, 2019
John Bradshaw, Brooks Paige, Matt J. Kusner, Marwin H. S. Segler, José Miguel Hernández-Lobato


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Are Generative Classifiers More Robust to Adversarial Attacks?

Jul 09, 2018
Yingzhen Li, John Bradshaw, Yash Sharma

* Presented as an oral talk at the ICML 2018 workshop on Theoretical Foundations and Applications of Deep Generative Models 

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Predicting Electron Paths

May 23, 2018
John Bradshaw, Matt J. Kusner, Brooks Paige, Marwin H. S. Segler, José Miguel Hernández-Lobato


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Adversarial Examples, Uncertainty, and Transfer Testing Robustness in Gaussian Process Hybrid Deep Networks

Jul 08, 2017
John Bradshaw, Alexander G. de G. Matthews, Zoubin Ghahramani


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