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OpenBioSim / somd2 Public

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Add support for autogenerating ABFE restraints#166

Merged

lohedges merged 4 commits into

develOpenBioSim/somd2:develfrom

feature_abfe_restraintsOpenBioSim/somd2:feature_abfe_restraintsCopy head branch name to clipboard

Jul 3, 2026

Conversation Commits4 (4)Checks Files changed

Merged

Add support for autogenerating ABFE restraints#166
lohedges merged 4 commits into
develfrom
feature_abfe_restraints

Commits

Commits on Jul 2, 2026

Add support for generating Boresch restraints for ABFE.
lohedges
committed
Add support for split restraint levers in ABFE schedules.
lohedges
committed

Commits on Jul 3, 2026

Store auto-generated standard state correction in parquet metadata.
lohedges
committed
Harmonise dependency version formatting.
lohedges
committed

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