ReactionMechanismGenerator / ARC

ARC - Automatic Rate Calculator
https://reactionmechanismgenerator.github.io/ARC/index.html
MIT License
43 stars 21 forks source link

Am fixup #671

Closed kfir4444 closed 1 year ago

kfir4444 commented 1 year ago

Solves issues with intra_substitutionS_cyclization and halocarbene_recombination. Tests were added as well.

codecov[bot] commented 1 year ago

Codecov Report

Merging #671 (fb1d4c2) into main (df3c323) will increase coverage by 0.01%. The diff coverage is 100.00%.

@@            Coverage Diff             @@
##             main     #671      +/-   ##
==========================================
+ Coverage   73.16%   73.18%   +0.01%     
==========================================
  Files          99       99              
  Lines       26414    26423       +9     
  Branches     5534     5534              
==========================================
+ Hits        19327    19338      +11     
+ Misses       5719     5718       -1     
+ Partials     1368     1367       -1     
Flag Coverage Δ
unittests 73.18% <100.00%> (+0.01%) :arrow_up:

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Impacted Files Coverage Δ
arc/mapping/driver_test.py 98.10% <ø> (ø)
arc/mapping/engine.py 89.20% <100.00%> (ø)
arc/mapping/engine_test.py 99.54% <100.00%> (+<0.01%) :arrow_up:
arc/reaction_test.py 89.56% <100.00%> (+0.12%) :arrow_up:

... and 1 file with indirect coverage changes

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