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1.0.1

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@DimaMolod DimaMolod released this 04 May 11:58
· 55 commits to main since this release

What's Changed

  • Optimize memory by keeping PAE matrices as numpy arrays, credits to @HenriettaHolze
  • A new flag to skip expensive biophysical scores computation. Thanks to @HenriettaHolze
  • New flag to force recompute summary csv files
  • New flag to skip saving PAE png plots
  • New flag to change filenames of the output interfaces.csv

New Contributors

Full Changelog: 1.0.0...1.0.1