├── Affinity ├── __init__.py └── src │ ├── CASF.py │ ├── PocketAnchor.py │ └── __init__.py ├── LICENSE ├── PocketDetection ├── __init__.py └── src │ ├── COACH420.py │ ├── HOLO4k.py │ ├── PDBbase.py │ ├── PocketAnchor.py │ ├── __init__.py │ └── scPDB.py ├── README.md ├── common ├── __init__.py └── src │ ├── __init__.py │ ├── datasets │ ├── __init__.py │ ├── base.py │ └── utils.py │ └── models │ ├── __init__.py │ ├── base.py │ ├── loss.py │ └── utils.py ├── figure └── pocketanchor.png ├── runPrediction.py └── runTrain.py /Affinity/__init__.py: -------------------------------------------------------------------------------- 1 | -------------------------------------------------------------------------------- /Affinity/src/CASF.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/tiantz17/PocketAnchor/HEAD/Affinity/src/CASF.py -------------------------------------------------------------------------------- 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