openff-interchange
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Update topology/system particle bookkeeping in OpenMM
Description
Resolves #1049
Checklist
- [x] Add tests
- [x] Reproduce issue #1049
- [x] Test topology indexing and without collating
- [x] Lint
- [x] Update documentation
- [x] Update docstrings
- [x] Add section to user guide on user expectations
Codecov Report
Attention: Patch coverage is 95.23810% with 1 line in your changes missing coverage. Please review.
Project coverage is 93.59%. Comparing base (
69b8955) to head (4ed0ac3). Report is 48 commits behind head on develop.
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