100 by 100 Generated Ligands from CrossDocked2020 Benchmark Pockets with DeepICL
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https://zenodo.org/records/12623708
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资源简介：
100 ligands are generated for each pocket in CrossDocked2020 benchmark set, following the splitting method of [Luo et al.](https://arxiv.org/pdf/2203.10446)
Note that DeepICL was trained on PDBbind v.2020, thus an overlap of pockets between the training set and CrossDocked2020 test set may exist.
Validity: 99.08 %
Uniqueness: 98.67 %
Novelty: 99.18 %
创建时间：
2024-07-02
