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  1. 10581

    Assessing interaction recovery of predicted protein-ligand poses by David Errington, Constantin Schneider, Cédric Bouysset, Frédéric A. Dreyer

    Published 2025-05-01
    “…Abstract The field of protein-ligand pose prediction has seen significant advances in recent years, with machine learning-based methods now being commonly used in lieu of classical docking methods or even to predict all-atom protein-ligand complex structures. …”
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    Understanding and Predicting Northwest Atlantic Shelf Temperature Variability by Ke Chen

    Published 2025-07-01
    “…These changes carry significant implications for marine ecosystems, fisheries, and coastal communities, underscoring the importance of understanding and predicting coastal variability. Koul et al. (2024), https://doi.org/10.1029/2024gl110946 contribute to this effort by utilizing a high‐resolution regional ocean model downscaled from a global prediction system to forecast a pause in the rapid warming of the Northwest Atlantic Shelf in the coming decade. …”
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