duartegroup / autodE

automated reaction profile generation
https://duartegroup.github.io/autodE/
MIT License
173 stars 52 forks source link

V1.3.5 #248

Closed t-young31 closed 1 year ago

codecov[bot] commented 1 year ago

Codecov Report

Merging #248 (dded76b) into master (6813afd) will increase coverage by 0.03%. The diff coverage is 100.00%.

@@            Coverage Diff             @@
##           master     #248      +/-   ##
==========================================
+ Coverage   97.13%   97.16%   +0.03%     
==========================================
  Files         196      196              
  Lines       20131    20214      +83     
==========================================
+ Hits        19554    19641      +87     
+ Misses        577      573       -4     
Flag Coverage Δ
unittests 97.16% <100.00%> (+0.03%) :arrow_up:

Flags with carried forward coverage won't be shown. Click here to find out more.

Impacted Files Coverage Δ
autode/units.py 100.00% <ø> (ø)
setup.py 0.00% <ø> (ø)
autode/__init__.py 100.00% <100.00%> (ø)
autode/hessians.py 99.17% <100.00%> (ø)
autode/log/log.py 93.75% <100.00%> (+0.41%) :arrow_up:
autode/values.py 100.00% <100.00%> (+0.36%) :arrow_up:
autode/wrappers/QChem.py 97.47% <100.00%> (+0.67%) :arrow_up:
autode/wrappers/XTB.py 98.53% <100.00%> (-0.03%) :arrow_down:
tests/test_hessian.py 98.59% <100.00%> (+0.02%) :arrow_up:
tests/test_log.py 94.44% <100.00%> (+0.69%) :arrow_up:
... and 6 more

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