Publications
Publications including preprints. An asterisk (*) indicates equal contributions.
Preprints and Workshop Articles
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Do Better QM9 Models Extrapolate as Better Quantum Chemical Property Predictors? NeurIPS Machine Learning and the Physical Sciences Workshop, 2022. [link]
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Towards Creating Benchmark Datasets of Universal Neural Network Potential for Material Discovery NeurIPS Machine Learning and the Physical Sciences Workshop, 2022. [link]
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Time-varying Gaussian Process Bandit Optimization with Non-constant Evaluation Time arXiv preprint arXiv:2003.04691 [arXiv]
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Domain Discrepancy Measure Using Complex Models in Unsupervised Domain Adaptation Symbolic-Neural Learning Workshop, 2022. [arXiv]