Protein-Ligand Binding Affinity Prediction - Groups

PDBbind v2020 Refined Dataset

The PDBbind v2020 refined dataset is a widely used training dataset for protein-ligand binding affinity prediction.

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DualBind: A Dual-Loss Framework for Protein-Ligand Binding Affinity Prediction

Accurate prediction of protein-ligand binding energies is a fundamental task in drug discovery workflow, as it directly influences the prioritization and optimization of...

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PROTEINS

A dataset for learning distributed representations of graphs using discrete substructure patterns and neural language models.

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3 datasets found

PDBbind v2020 Refined Dataset

DualBind: A Dual-Loss Framework for Protein-Ligand Binding Affinity Prediction

PROTEINS