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@epretti epretti commented Dec 12, 2025

Adds support for SMIRNOFF virtual sites. Still draft quality; needs more testing for loading multiple OFFXML force field files simultaneously (this was necessary for some virtual site tests)

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Codecov Report

❌ Patch coverage is 98.55072% with 1 line in your changes missing coverage. Please review.
✅ Project coverage is 84.41%. Comparing base (1c969a6) to head (fbd23bf).

Files with missing lines Patch % Lines
...penmmforcefields/generators/template_generators.py 98.55% 1 Missing ⚠️
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Additional details and impacted files
@@            Coverage Diff             @@
##             main     #423      +/-   ##
==========================================
+ Coverage   84.17%   84.41%   +0.23%     
==========================================
  Files           5        5              
  Lines         771      789      +18     
==========================================
+ Hits          649      666      +17     
- Misses        122      123       +1     

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2 participants