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using GufeQuantity instead of deprecated OpenFF models - #130

Merged
ijpulidos merged 12 commits into
mainfrom
use-gufe-quantities
Nov 7, 2025
Merged

using GufeQuantity instead of deprecated OpenFF models#130
ijpulidos merged 12 commits into
mainfrom
use-gufe-quantities

Depending on 1.7.1 openfe as suggested.

73b6bb1
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Codecov / codecov/project failed Nov 6, 2025 in 0s

86.35% (-0.51%) compared to 639b258

View this Pull Request on Codecov

86.35% (-0.51%) compared to 639b258

Details

Codecov Report

✅ All modified and coverable lines are covered by tests.
✅ Project coverage is 86.35%. Comparing base (639b258) to head (73b6bb1).
⚠️ Report is 4 commits behind head on main.

Additional details and impacted files
@@            Coverage Diff             @@
##             main     #130      +/-   ##
==========================================
- Coverage   86.86%   86.35%   -0.51%     
==========================================
  Files          11       11              
  Lines        1439     1444       +5     
==========================================
- Hits         1250     1247       -3     
- Misses        189      197       +8     

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