Add generate_thermo_ensemble: charge-state-aware conformers with auto-retry - #121
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Codecov / codecov/project
succeeded
Jul 11, 2026 in 1s
97.34% (+0.02%) compared to 0636de4
View this Pull Request on Codecov
97.34% (+0.02%) compared to 0636de4
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Codecov Report
✅ All modified and coverable lines are covered by tests.
✅ Project coverage is 97.34%. Comparing base (0636de4) to head (caf56e3).
Additional details and impacted files
@@ Coverage Diff @@
## main #121 +/- ##
==========================================
+ Coverage 97.31% 97.34% +0.02%
==========================================
Files 32 32
Lines 1940 1957 +17
==========================================
+ Hits 1888 1905 +17
Misses 52 52 ☔ View full report in Codecov by Harness.
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