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Computational Complexity in Electronic Structure, , и . CoRR, (2012)Olympus: a benchmarking framework for noisy optimization and experiment planning., , , , , , , и . CoRR, (2020)Scientific intuition inspired by machine learning generated hypotheses., , , и . CoRR, (2020)A Sober Look at LLMs for Material Discovery: Are They Actually Good for Bayesian Optimization Over Molecules?, , , , , и . CoRR, (2024)Tartarus: A Benchmarking Platform for Realistic And Practical Inverse Molecular Design., , , , , , и . CoRR, (2022)Natural Evolutionary Strategies for Variational Quantum Computation., , и . CoRR, (2020)Computer vision for liquid samples in hospitals and medical labs using hierarchical image segmentation and relations prediction., , и . CoRR, (2021)Predicting 3D shapes, masks, and properties of materials, liquids, and objects inside transparent containers, using the TransProteus CGI dataset., , , и . CoRR, (2021)JANUS: Parallel Tempered Genetic Algorithm Guided by Deep Neural Networks for Inverse Molecular Design., , и . CoRR, (2021)Learning quantum dynamics with latent neural ODEs., , , и . CoRR, (2021)