add docs for gathering septop and abfe #1737
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atravitz
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Codecov Report✅ All modified and coverable lines are covered by tests. Additional details and impacted files@@ Coverage Diff @@
## main #1737 +/- ##
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- Coverage 95.36% 93.13% -2.23%
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Files 189 189
Lines 16536 16647 +111
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- Hits 15770 15505 -265
- Misses 766 1142 +376
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Just the one thing re: absolute calculations, otherwise lgtm!
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Co-authored-by: Irfan Alibay <IAlibay@users.noreply.github.com>
atravitz
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Dec 8, 2025
| "openmmforcefields", | ||
| "psutil", | ||
| "py3Dmol", | ||
| "zstandard", |
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fixes breaking docs upstream
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No API break detected ✅ |
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newsentry, or the changes are not user-facing.pre-commit.ci autofixbefore requesting review.Manual Tests: these are slow so don't need to be run every commit, only before merging and when relevant changes are made (generally at reviewer-discretion).
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