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nlesc-nano / auto-FOX

A library for analyzing potential energy surfaces (PESs) and using the resulting PES descriptors for constructing forcefield parameters.
GNU Lesser General Public License v3.0
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MAINT: General maintenance in preperation for Auto-FOX 1.0.0 #283

Closed BvB93 closed 1 year ago

BvB93 commented 1 year ago

Performs some general maintenance in relation to the upcoming Auto-FOX 1.0.0 release:

codecov[bot] commented 1 year ago

Codecov Report

Merging #283 (89a77f0) into master (8354649) will decrease coverage by 0.06%. The diff coverage is 100.00%.

@@            Coverage Diff             @@
##           master     #283      +/-   ##
==========================================
- Coverage   72.44%   72.38%   -0.06%     
==========================================
  Files          66       66              
  Lines        7112     7112              
  Branches     1494     1494              
==========================================
- Hits         5152     5148       -4     
- Misses       1635     1639       +4     
  Partials      325      325
Impacted Files Coverage Δ
FOX/__version__.py 100.00% <100.00%> (ø)

... and 3 files with indirect coverage changes