Protein-Ligand Dataset Missing

by AmelieSchreiber - opened Sep 3, 2024

Sep 3, 2024

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edited Sep 3, 2024

Hi, thanks for the amazing work. It seems as though the dataset for the protein-ligand docking task is missing. The only dataset present is the dataset for protein conformational sampling. Also, the directions on how to perform docking with a new small molecule using DiG are not very clear. Please advise on how to get the dataset and how to perform docking with Distributional Graphormer.

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