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matthewcarbone / Crescendo

A greatly abstracted machine learning suite built for ease of use, powered by Hydra + Lightning
BSD 3-Clause "New" or "Revised" License
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MPNN #42

Closed matthewcarbone closed 4 years ago

matthewcarbone commented 4 years ago

This PR adds an MPNN and supporting architecture.

Resolve #37

matthewcarbone commented 4 years ago

Codecov Report

Merging #42 into master will increase coverage by 5.08%. The diff coverage is 100.00%.

Impacted file tree graph

@@            Coverage Diff             @@
##           master      #42      +/-   ##
==========================================
+ Coverage   75.00%   80.08%   +5.08%     
==========================================
  Files           7       10       +3     
  Lines         396      457      +61     
==========================================
+ Hits          297      366      +69     
+ Misses         99       91       -8
Impacted Files Coverage Δ
crescendo/datasets/qm9.py 72.40% <100.00%> (+4.08%) :arrow_up:
crescendo/models/embedding.py 100.00% <100.00%> (ø)
crescendo/models/mpnn.py 100.00% <100.00%> (ø)
crescendo/utils/graphs.py 100.00% <100.00%> (ø)

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