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ReactionMechanismGenerator / AutoTST

AutoTST: A framework to perform automated transition state theory calculations
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use `getReactionTemplate` to `estimateDistancesUsingGroupAdditivity` #38

Closed davidfarinajr closed 5 years ago

codecov[bot] commented 5 years ago

Codecov Report

Merging #38 into master will decrease coverage by <.01%. The diff coverage is 100%.

Impacted file tree graph

@@            Coverage Diff             @@
##           master      #38      +/-   ##
==========================================
- Coverage   63.58%   63.57%   -0.01%     
==========================================
  Files          25       25              
  Lines        4421     4420       -1     
==========================================
- Hits         2811     2810       -1     
  Misses       1610     1610
Impacted Files Coverage Δ
autotst/data/base.py 38.68% <100%> (-0.12%) :arrow_down:

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