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Add PyTorch nightlies to "dev" CI #186

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Add PyTorch nightlies to "dev" CI #186

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c9cf07f
Add PyTorch nightlies
mattwthompson Feb 14, 2025
c8f93cb
Drop other CI
mattwthompson Feb 14, 2025
36dec7a
Run nightlies in this PR
mattwthompson Feb 14, 2025
ced03da
Revert "Drop other CI"
mattwthompson Feb 18, 2025
fd7f3da
Drop nightly channel
mattwthompson Feb 19, 2025
673ca01
Debug
mattwthompson Feb 19, 2025
ddab865
Merge remote-tracking branch 'upstream/main' into pytorch-nightlies
mattwthompson Mar 27, 2025
46a2ccb
Force NumPy 1
mattwthompson Mar 31, 2025
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2 changes: 2 additions & 0 deletions .github/workflows/dev-ci.yaml
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Original file line number Diff line number Diff line change
@@ -1,5 +1,7 @@
name: Upstream nightly version CI
on:
push:
pull_request:
schedule:
# weekly tests, Sundays at midnight
- cron: "0 0 * * 0"
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12 changes: 7 additions & 5 deletions devtools/conda-envs/nightly.yaml
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Expand Up @@ -2,11 +2,11 @@ name: openff-nagl-test
channels:
- openeye
- conda-forge
- pytorch-nightly
dependencies:
# Base depends
- python
- pip
- numpy =1

# UI
- click
Expand All @@ -20,9 +20,7 @@ dependencies:
- openeye-toolkits

# gnn
- pytorch
- torchvision
- torchaudio
- pytorch ~=2.6

# database
- pyarrow
Expand Down Expand Up @@ -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

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