New preprint: Ensemble-Conditioned Molecular Design guides 3D generation on multiple structural conditions
charlieharris01 · x · 2026-09-23
A new preprint, Ensemble-Conditioned Molecular Design, tackles incorporating dynamic structural information into 3D molecular generators by guiding sampling across multiple structural conditions.
Related event: AstraZeneca Team Unveils Ensemble-Conditioned 3D Molecular Design Method(2 posts)→
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