yoshida-lab / XenonPy

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

Release v0.5.0 #223

Closed TsumiNa closed 3 years ago

TsumiNa commented 3 years ago

@stewu5 Please check https://github.com/yoshida-lab/XenonPy/pull/223/files#diff-3b7c33aad76501d378ca37e20c9c6062356834e40ced388f3e249923cd555ead

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codecov[bot] commented 3 years ago

Codecov Report

Merging #223 (6716057) into master (9e0b796) will not change coverage. The diff coverage is n/a.

Impacted file tree graph

@@           Coverage Diff           @@
##           master     #223   +/-   ##
=======================================
  Coverage   35.42%   35.42%           
=======================================
  Files          95       95           
  Lines        6825     6825           
=======================================
  Hits         2418     2418           
  Misses       4407     4407           
Impacted Files Coverage Δ
tests/contrib/descriptor/test_mordred.py 96.87% <ø> (ø)
tests/contrib/ismd/test_reactant_pool.py 100.00% <ø> (ø)
tests/contrib/ismd/test_reactor.py 100.00% <ø> (ø)

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TsumiNa commented 3 years ago

@stewu5 I also changed the README.md in the contrib folder, please check it.