BA-Pred and RMSD-Pred: Integrated Graph Neural Network Models for Accurate Protein-Ligand Binding Affinity and Binding Pose Prediction

Jaemin Sim, Juyong Lee. BA-Pred and RMSD-Pred: Integrated Graph Neural Network Models for Accurate Protein-Ligand Binding Affinity and Binding Pose Prediction. Journal of Chemical Information and Computer Sciences, 66(7):3480-3495, 2026. [doi]

Authors

Jaemin Sim

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Juyong Lee

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