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MR-GAN: Manifold Regularized Generative Adversarial Networks for Scientific Data., , , , , , , and . SIAM J. Math. Data Sci., 3 (4): 1197-1222 (2021)Explainable Deep Learning for Uncovering Actionable Scientific Insights for Materials Discovery and Design., , , , , , and . CoRR, (2020)Probabilistic Neighbourhood Component Analysis: Sample Efficient Uncertainty Estimation in Deep Learning., , , , and . CoRR, (2020)Deep Probabilistic Kernels for Sample-Efficient Learning., , , , and . CoRR, (2019)Deep kernels with probabilistic embeddings for small-data learning., , , , and . UAI, volume 161 of Proceedings of Machine Learning Research, page 918-928. AUAI Press, (2021)Actionable Attribution Maps for Scientific Machine Learning., , , , , , and . CoRR, (2020)Pipelines for Procedural Information Extraction from Scientific Literature: Towards Recipes using Machine Learning and Data Science., , , , , , , , , and 3 other author(s). OST@ICDAR, page 41-46. IEEE, (2019)Mix-n-Match : Ensemble and Compositional Methods for Uncertainty Calibration in Deep Learning., , and . ICML, volume 119 of Proceedings of Machine Learning Research, page 11117-11128. PMLR, (2020)Automated Identification of Molecular Crystals' Packing Motifs., , , , and . J. Chem. Inf. Model., 60 (12): 6147-6154 (2020)Predicting Energetics Materials' Crystalline Density from Chemical Structure by Machine Learning., , , , , and . J. Chem. Inf. Model., 61 (5): 2147-2158 (2021)