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OpenFreeEnergy / openfe Public

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feat: exorcist worker #1833

Open

ethanholz wants to merge 20 commits intoOpenFreeEnergy:feat/warehouseOpenFreeEnergy/openfe:feat/warehousefrom

ethanholz:feat/exorcistethanholz/openfe:feat/exorcistCopy head branch name to clipboard

Conversation Commits20 (20)Checks Files changed

Open

feat: exorcist worker #1833
ethanholz wants to merge 20 commits intoOpenFreeEnergy:feat/warehousefrom
ethanholz:feat/exorcist

Commits

Commits on Feb 18, 2026

feat: add warehouse primitives for handling protocol units
ethanholz
committed
feat: inital worker for exorcist
ethanholz
committed
test: add tests for warehouse
ethanholz
committed
fix: can now return protocol unit
ethanholz
committed
refactor: make things more consistent
ethanholz
committed
test: initial test setup for orchestration subpackage
ethanholz
committed
test: initial exorcist utility testing
ethanholz
committed
refactor: provide a root path to the exorcist DB
ethanholz
committed
test: inital worker testing
ethanholz
committed
feat: add shared_store
ethanholz
committed
feat: add better handling for CLI application
ethanholz
committed
test: add new worker tests
ethanholz
committed
feat: add exorcist worker to CLI
ethanholz
committed
test: add for worker CLI command
ethanholz
committed
docs: add numpy docstrings
ethanholz
committed
feat: add support for planning an RBFE to a Warehouse
ethanholz
committed

Commits on Mar 6, 2026

fix: correct edge direction for task graph
ethanholz
committed
refactor: remove extra debugging from warehouse
ethanholz
committed
refactor: cleanup handling of tasks for worker
ethanholz
committed
refactor: fix issues in the CLI for running the worker
ethanholz
committed

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