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This PR introduced the AlchemicalArchive for serializing an AlchemicalNetwork along with it's transformation results. Closes #323.

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codecov bot commented Dec 3, 2025

Codecov Report

❌ Patch coverage is 97.72727% with 1 line in your changes missing coverage. Please review.
✅ Project coverage is 98.75%. Comparing base (5c281ff) to head (91c4a02).

Files with missing lines Patch % Lines
gufe/archival.py 97.72% 1 Missing ⚠️
Additional details and impacted files
@@            Coverage Diff             @@
##             main     #687      +/-   ##
==========================================
- Coverage   98.76%   98.75%   -0.02%     
==========================================
  Files          40       41       +1     
  Lines        2517     2561      +44     
==========================================
+ Hits         2486     2529      +43     
- Misses         31       32       +1     

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@ianmkenney ianmkenney force-pushed the feat/AlchemicalArchive branch from d3f33c9 to fe155bf Compare December 3, 2025 14:55
@ianmkenney ianmkenney force-pushed the feat/AlchemicalArchive branch from fe155bf to 3b00b6f Compare December 3, 2025 15:33
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github-actions bot commented Dec 8, 2025

No API break detected ✅

@ianmkenney ianmkenney requested a review from atravitz December 8, 2025 17:10
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Define AlchemicalArchive object for use as archival artifact

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