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Return every atom map per reaction and cluster them into distinct reaction channels - #1024

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kfir4444 wants to merge 8 commits into
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atom_map_clustering
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Return every atom map per reaction and cluster them into distinct reaction channels#1024
kfir4444 wants to merge 8 commits into
mainfrom
atom_map_clustering

Test that sec-butyl to n-butyl resolves into its two migration channels

c8b75f7
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Codecov / codecov/project succeeded Aug 27, 2026 in 0s

64.86% (+0.09%) compared to 09e9ede

View this Pull Request on Codecov

64.86% (+0.09%) compared to 09e9ede

Details

Codecov Report

✅ All modified and coverable lines are covered by tests.
✅ Project coverage is 64.86%. Comparing base (09e9ede) to head (c8b75f7).
⚠️ Report is 1 commits behind head on main.

Additional details and impacted files
@@            Coverage Diff             @@
##             main    #1024      +/-   ##
==========================================
+ Coverage   64.76%   64.86%   +0.09%     
==========================================
  Files         119      120       +1     
  Lines       40039    40503     +464     
  Branches    10350    10448      +98     
==========================================
+ Hits        25932    26271     +339     
- Misses      11129    11243     +114     
- Partials     2978     2989      +11     

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