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Offline Model-based Optimization for Real-World Molecular Discovery

Dong-Hee Shin, Young-Han Son, Hyun Jung Lee, Deok-Joong Lee, Tae-Eui Kam. Offline Model-based Optimization for Real-World Molecular Discovery. In Forty-second International Conference on Machine Learning, ICML 2025, Vancouver, BC, Canada, July 13-19, 2025. OpenReview.net, 2025. [doi]

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Dong-Hee Shin

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Young-Han Son

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Hyun Jung Lee

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Deok-Joong Lee

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Tae-Eui Kam

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