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Add sp_composite focal-point/CBS single-point protocols #878

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Changed max barrier for rotor threshold from 40 to 60 kJ/mol

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Add sp_composite focal-point/CBS single-point protocols #878

Changed max barrier for rotor threshold from 40 to 60 kJ/mol
0045d6f
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Codecov / codecov/project succeeded May 9, 2026 in 0s

61.35% (+0.91%) compared to 5869abc

View this Pull Request on Codecov

61.35% (+0.91%) compared to 5869abc

Details

Codecov Report

✅ All modified and coverable lines are covered by tests.
✅ Project coverage is 61.35%. Comparing base (5869abc) to head (0045d6f).
⚠️ Report is 1 commits behind head on main.

Additional details and impacted files 
@@            Coverage Diff             @@
##             main     #878      +/-   ##
==========================================
+ Coverage   60.43%   61.35%   +0.91%     
==========================================
  Files         103      110       +7     
  Lines       31165    32155     +990     
  Branches     8126     8332     +206     
==========================================
+ Hits        18835    19729     +894     
- Misses       9968    10002      +34     
- Partials     2362     2424      +62

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