diff --git a/.github/workflows/dev-ci.yaml b/.github/workflows/dev-ci.yaml index 40e9b86..6d06b0c 100644 --- a/.github/workflows/dev-ci.yaml +++ b/.github/workflows/dev-ci.yaml @@ -1,5 +1,7 @@ name: Upstream nightly version CI on: + push: + pull_request: schedule: # weekly tests, Sundays at midnight - cron: "0 0 * * 0" diff --git a/devtools/conda-envs/nightly.yaml b/devtools/conda-envs/nightly.yaml index 5ea8f9e..a92291a 100644 --- a/devtools/conda-envs/nightly.yaml +++ b/devtools/conda-envs/nightly.yaml @@ -2,11 +2,11 @@ name: openff-nagl-test channels: - openeye - conda-forge - - pytorch-nightly dependencies: # Base depends - python - pip + - numpy =1 # UI - click @@ -20,9 +20,7 @@ dependencies: - openeye-toolkits # gnn - - pytorch - - torchvision - - torchaudio + - pytorch ~=2.6 # database - pyarrow @@ -63,5 +61,9 @@ dependencies: - git+https://github.com/openforcefield/openff-toolkit.git@main - git+https://github.com/openforcefield/openff-recharge.git@main - git+https://github.com/openforcefield/openff-units.git@main - + - --pre + - --extra-index-url https://download.pytorch.org/whl/nightly/cpu + - torch + - torchvision + - torchaudio