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2 changes: 2 additions & 0 deletions .github/workflows/full-stack.yaml
Original file line number Diff line number Diff line change
Expand Up @@ -38,6 +38,7 @@ jobs:
uses: actions/checkout@v7
with:
repository: openforcefield/openff-interchange
ref: "fix-pydantic"
path: openff-interchange

- name: Checkout QCSubmit
Expand All @@ -58,6 +59,7 @@ jobs:
uses: actions/checkout@v7
with:
repository: openforcefield/openff-units
ref: "define-pydantic-schema"
path: openff-units

- name: Checkout OpenFF Utilities
Expand Down
10 changes: 7 additions & 3 deletions devtools/conda-envs/full-stack.yaml
Original file line number Diff line number Diff line change
@@ -1,13 +1,13 @@
name: full-stack-tests
channels:
- openeye
- conda-forge/label/openff-interchange-dev
- conda-forge
dependencies:
- python
- setuptools =81
- pip
- numpy >=2.4
- pydantic =2.11.10
- pydantic >=2.12
- pint >=0.25
- openff-toolkit >=0.18
- ambertools =24.8 # just to help solver
Expand All @@ -24,7 +24,7 @@ dependencies:
- toml
- bson
- msgpack-python
- openeye-toolkits >=2025
- openeye::openeye-toolkits >=2025
- rdkit >=2025.09.5
- intermol

Expand All @@ -50,3 +50,7 @@ dependencies:
- openmpi =4

- icu=75 # just to help solver

- pip:
- git+https://github.com/openforcefield/openff-units.git@define-pydantic-schema
- git+https://github.com/openforcefield/openff-interchange.git@fix-pydantic