search

yoshida-lab / XenonPy

XenonPy is a Python Software for Materials Informatics
http://xenonpy.readthedocs.io
BSD 3-Clause "New" or "Revised" License
133 stars 57 forks source link

Implement MDL features #62

Closed TsumiNa closed 5 years ago

TsumiNa commented 5 years ago

Close #61

codecov[bot] commented 5 years ago

Codecov Report

Merging #62 into develop will increase coverage by 0.04%. The diff coverage is 80%.

Impacted file tree graph

@@            Coverage Diff             @@
##           develop     #62      +/-   ##
==========================================
+ Coverage    79.25%   79.3%   +0.04%     
==========================================
  Files           49      51       +2     
  Lines         3606    3716     +110     
==========================================
+ Hits          2858    2947      +89     
- Misses         748     769      +21
Impacted Files Coverage Δ
xenonpy/descriptor/base.py 82.31% <100%> (ø) :arrow_up:
xenonpy/datatools/__init__.py 100% <100%> (ø) :arrow_up:
xenonpy/descriptor/fingerprint.py 94.33% <100%> (ø) :arrow_up:
xenonpy/descriptor/composition.py 90% <100%> (ø) :arrow_up:
xenonpy/model/nn/checker.py 86.11% <100%> (+0.19%) :arrow_up:
xenonpy/datatools/mdl.py 65.07% <65.07%> (ø)
xenonpy/descriptor/frozen_featurizer.py 88.88% <80%> (-1.81%) :arrow_down:
tests/inverse/test_base_inverse.py 85.49% <84.21%> (-0.22%) :arrow_down:
xenonpy/descriptor/structure.py 45.2% <87.5%> (+0.76%) :arrow_up:
tests/datatools/test_mdl.py 95.65% <95.65%> (ø)
... and 5 more

Continue to review full report at Codecov.

Legend - Click here to learn more Δ = absolute <relative> (impact), ø = not affected, ? = missing data Powered by Codecov. Last update 010e6a9...d16645f. Read the comment docs.