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    Co-folding, the future of docking – prediction of allosteric and orthosteric ligands

    Co-folding, the future of docking – prediction of allosteric and orthosteric ligands by Eva Nittinger, Özge Yoluk, Alessandro Tibo, Gustav Olanders, Christian Tyrchan

    Published 2025-12-01
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    WEISS: Wasserstein efficient sampling strategy for LLMs in drug design

    WEISS: Wasserstein efficient sampling strategy for LLMs in drug design by Riccardo Tedoldi, Junyong Li, Ola Engkvist, Andrea Passerini, Annie M Westerlund, Alessandro Tibo

    Published 2025-01-01
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