openfe

mirror of https://github.com/OpenFreeEnergy/openfe.git synced 2026-06-04 22:34:24 +08:00

Files

Josh Horton 7bc31e1df5 Fix 1-4 interpolation for core-dummy interactions (#1856 )

* Change the 1-4 interpolation to be on by default.
* Add htf tests including tests for 1-4 interpolation.

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Co-authored-by: Hannah Baumann <43765638+hannahbaumann@users.noreply.github.com>
Co-authored-by: Irfan Alibay <IAlibay@users.noreply.github.com>

2026-04-28 15:05:48 +01:00

cli

Update the userguide CLI docs to mention resuming (#1878 )

2026-03-30 14:47:02 -07:00

execution

Update the userguide CLI docs to mention resuming (#1878 )

2026-03-30 14:47:02 -07:00

protocols

Fix 1-4 interpolation for core-dummy interactions (#1856 )

2026-04-28 15:05:48 +01:00

results

renaming to Results Gathering