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3 Results
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Workshop
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Towards a Reinforcement Learning framework for purely online 3D-molecular structure discovery Bjarke Hastrup · François Cornet · Tejs Vegge · Arghya Bhowmik |
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Workshop
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Efficient Autoencoder Pipeline for Discovering High Entropy Alloys with Molecular Dynamics Data Amirhossein Naghdi Dorabati · Grzegorz Kaszuba · Stefanos Papanikolaou · Andrzej Jaszkiewicz · Piotr Sankowski |
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Workshop
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Applying Multi-Fidelity Bayesian Optimization in Chemistry: Open Challenges and Major Considerations Edmund Judge · Mohammed Azzouzi · Austin Mroz · Antonio del Rio Chanona · Kim Jelfs |