feat: filesystem exorcist worker - #1833

Merged

atravitz merged 48 commits into

OpenFreeEnergy:epic/execution_improvementsfrom

ethanholz:feat/exorcist

Jul 30, 2026

Commits on Nov 3, 2025

refactor: remove result_server references in favor of gufe ExternalStorage (#1632)

ethanholz
and
atravitz
authored
e12164b

Commits on Nov 6, 2025

refactor: rename to WarehouseBaseClass (#1660)
ethanholz
authored
c27bfa5

Commits on Nov 24, 2025

Merge branch 'main' of github.com:OpenFreeEnergy/openfe into feat/warehouse
atravitz
committed
8d9995c
feat/refactor: add setup store (#1671)

ethanholz
and
atravitz
authored
e0038e7

Commits on Jan 23, 2026

Temporarily build pooch from main w/ hotfix (#1806)
atravitz
committed
f6b8499
Merge branch 'main' of github.com:OpenFreeEnergy/openfe into feat/warehouse
atravitz
committed
0e186a0
Add support for result tokenizables to warehouse (#1763)

ethanholz
and
atravitz
authored
efb3500

Commits on Jan 28, 2026

Commits on Feb 18, 2026

Merge branch 'main' of github.com:OpenFreeEnergy/openfe into feat/warehouse
atravitz
committed
fd24777

Commits on Mar 5, 2026

Merge branch 'main' into feat/warehouse
atravitz
authored
70c62d0

Commits on Jun 4, 2026

Merge branch 'main' of github.com:OpenFreeEnergy/openfe into feat/warehouse
atravitz
committed
7ec596b
feat: add warehouse primitives for handling protocol units

ethanholz
authored and
atravitz
committed
d9b0ff7
feat: inital worker for exorcist

ethanholz
authored and
atravitz
committed
0d11be5
test: add tests for warehouse

ethanholz
authored and
atravitz
committed
5135713
fix: can now return protocol unit

ethanholz
authored and
atravitz
committed
f113a3a
refactor: make things more consistent

ethanholz
authored and
atravitz
committed
cb50733
test: initial test setup for orchestration subpackage

ethanholz
authored and
atravitz
committed
682d77c
test: initial exorcist utility testing

ethanholz
authored and
atravitz
committed
8b70c76
refactor: provide a root path to the exorcist DB

ethanholz
authored and
atravitz
committed
25678e8
test: inital worker testing

ethanholz
authored and
atravitz
committed
0191fe1
feat: add shared_store

ethanholz
authored and
atravitz
committed
d2c45d7
feat: add better handling for CLI application

ethanholz
authored and
atravitz
committed
7726a17
test: add new worker tests

ethanholz
authored and
atravitz
committed
447d132
feat: add exorcist worker to CLI

ethanholz
authored and
atravitz
committed
2fb9a5a
test: add for worker CLI command

ethanholz
authored and
atravitz
committed
883d1b8
docs: add numpy docstrings

ethanholz
authored and
atravitz
committed
4246a44
feat: add support for planning an RBFE to a Warehouse

ethanholz
authored and
atravitz
committed
7565013
fix: correct edge direction for task graph

ethanholz
authored and
atravitz
committed
85d3adf
refactor: remove extra debugging from warehouse

ethanholz
authored and
atravitz
committed
dd0a2db
refactor: cleanup handling of tasks for worker

ethanholz
authored and
atravitz
committed
43f7fcb
refactor: fix issues in the CLI for running the worker

ethanholz
authored and
atravitz
committed
f29f16d

Commits on Jul 13, 2026

Commits on Jul 14, 2026

Commits on Jul 21, 2026

Merge branch 'main' of github.com:OpenFreeEnergy/openfe into feat/warehouse
atravitz
committed
54e876b

Commits on Jul 29, 2026

Merge branch 'main' into feat/warehouse
atravitz
authored
86caac0

Commits on Jul 30, 2026

Merge branch 'main' of github.com:OpenFreeEnergy/openfe into feat/warehouse
atravitz
committed
e2edac1
add news item
atravitz
committed
ee2ccd1
Merge branch 'main' of github.com:OpenFreeEnergy/openfe into feat/warehouse
atravitz
committed
801cafe
ignore a couple type check violations for now
atravitz
committed
755cfd1
Merge branch 'feat/warehouse' of github.com:OpenFreeEnergy/openfe into feat/exorcist
atravitz
committed
ee3fd58
Merge branch 'epic/execution_improvements' of github.com:OpenFreeEnergy/openfe into feat/exorcist
atravitz
committed
12d623f
fix type checking
atravitz
committed
93b500e
add exorcist to docs build
atravitz
committed
e8a0300