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Browse files- README.md +26 -0
- pbpp-2020.zip +3 -0
README.md
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---
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license: other
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task_categories:
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- other
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tags:
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- protein-ligand
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- molecular-docking
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- drug-discovery
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- structural-biology
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- pdb
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- binding-affinity
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size_categories:
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- 1K<n<10K
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---
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# PDBbind 2020 Refined Set
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Curated collection of 5,316 high-quality protein-ligand complexes with experimentally measured binding affinity data from PDBbind v.2020 refined set.
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## Structure
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- 5,316 directories named by PDB ID
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- Each contains: protein.pdb, pocket.pdb, ligand.mol2, ligand.sdf
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- Total size: ~2.7 GB
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## Citation
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Liu, Z.H. et al. Acc. Chem. Res. 2017, 50, 302-309.
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pbpp-2020.zip
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version https://git-lfs.github.com/spec/v1
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oid sha256:e69ae8b75be052026a9a7006613397e5840faebef7027ed85e1ce8c72d270f00
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size 625493784
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