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v0.4.0
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@amorehead amorehead released this 12 Aug 22:23
· 132 commits to main since this release
v0.4.0
c3b8f6d

Full Changelog: v.0.3.0...v0.4.0

Updates:

  • Renamed src root directory to posebench to support pip packaging
  • Updated dataset documentation in README.md

Additions:

  • Added and documented pip installation option
  • Added mmCIF to PDB file conversion script
  • Added apo-to-holo predicted protein structure accuracy assessment and plotting script
  • Added support to notebooks/dockgen_inference_results_plotting.ipynb for analyzing the protein-ligand interactions within the PDBBind 2020 dataset's experimental structures
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