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af3io

Collection of eclectic utilities for AlphaFold 3:

  • Copy data pipeline output from existing results: datafill.ipynb (open in Colab)
  • Differences between input JSON files: input_diff.ipynb (open in Colab)
  • Set the name attribute of input JSONs to match their file names: af3io fixname inputs/*.json (use --check to only report mismatches)
  • Collect summary confidences and interface scores (ipSAE, LIS, pDockQ, ...) from output directories or zip files, including predictions nested in other archives (tar, zip, gzip, zstd): af3io summary-confidences predictions/ pools_5k.tar summary_confidences.parquet
  • Compress confidences JSONs (experimental): confidences-compress.ipynb (open in Colab)

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Release files for af3io 26.10

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Source distribution for af3io 26.10
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