Add entropy and enthalpy #406
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Codecov ReportAll modified and coverable lines are covered by tests ✅
Additional details and impacted files@@ Coverage Diff @@
## master #406 +/- ##
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+ Coverage 98.78% 98.83% +0.04%
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Files 28 28
Lines 1978 2056 +78
Branches 435 454 +19
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+ Hits 1954 2032 +78
Misses 2 2
Partials 22 22 ☔ View full report in Codecov by Sentry. |
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Add enthalpy and entropy outputs for MBAR and BAR (via 2-state MBAR).