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Feat/update vdw radii #789

Feat/update vdw radii

Feat/update vdw radii #789

Triggered via pull request February 3, 2025 09:30
Status Cancelled
Total duration 8m 50s
Artifacts 4

test_and_deploy.yml

on: pull_request
Build CCD and wheel for reusing it in several CI jobs
4m 47s
Build CCD and wheel for reusing it in several CI jobs
Generate wheels matrix
9s
Generate wheels matrix
Check code style
9s
Check code style
Build documentation
1m 59s
Build documentation
Build source distribution
23s
Build source distribution
Test interfaces to databases and applications
3m 38s
Test interfaces to databases and applications
Test interface to Muscle 5
58s
Test interface to Muscle 5
Run benchmarks
3m 39s
Run benchmarks
Upload CCD to GitHub Releases
3s
Upload CCD to GitHub Releases
Matrix: Build & Test
Upload documentation to GitHub Releases and documentation website
0s
Upload documentation to GitHub Releases and documentation website
Upload package to GitHub Releases & PyPI
0s
Upload package to GitHub Releases & PyPI
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21 errors and 5 warnings
Build documentation
Process completed with exit code 2.
Build & Test (cp313-macosx_x86_64, macos-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp313-macosx_arm64, macos-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp312-macosx_x86_64, macos-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp311-macosx_arm64, macos-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp312-macosx_arm64, macos-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp312-macosx_arm64, macos-latest)
The operation was canceled.
Build & Test (cp310-win_amd64, windows-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp311-win_amd64, windows-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp313-win_amd64, windows-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp312-win_amd64, windows-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp310-macosx_arm64, macos-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Run benchmarks
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp312-manylinux_x86_64, ubuntu-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp311-manylinux_x86_64, ubuntu-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp310-manylinux_x86_64, ubuntu-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Test interfaces to databases and applications
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Test interfaces to databases and applications
The operation was canceled.
Build & Test (cp311-macosx_x86_64, macos-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp313-manylinux_x86_64, ubuntu-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Build & Test (cp310-macosx_x86_64, macos-latest)
Canceling since a higher priority waiting request for 'CI & CD-feat/update_vdw_radii' exists
Test interface to Muscle 5
The 'defaults' channel might have been added implicitly. If this is intentional, add 'defaults' to the 'channels' list. Otherwise, consider setting 'conda-remove-defaults' to 'true'.
Build documentation
/home/runner/miniconda3/lib/python3.12/site-packages/conda/base/context.py:201: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.3. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
Build documentation
The 'defaults' channel might have been added implicitly. If this is intentional, add 'defaults' to the 'channels' list. Otherwise, consider setting 'conda-remove-defaults' to 'true'.
Test interfaces to databases and applications
/home/runner/miniconda3/lib/python3.12/site-packages/conda/base/context.py:201: FutureWarning: Adding 'defaults' to channel list implicitly is deprecated and will be removed in 25.3. To remove this warning, please choose a default channel explicitly with conda's regular configuration system, e.g. by adding 'defaults' to the list of channels: conda config --add channels defaults For more information see https://docs.conda.io/projects/conda/en/stable/user-guide/configuration/use-condarc.html deprecated.topic(
Test interfaces to databases and applications
The 'defaults' channel might have been added implicitly. If this is intentional, add 'defaults' to the 'channels' list. Otherwise, consider setting 'conda-remove-defaults' to 'true'.

Artifacts

Produced during runtime
Name Size
ccd
33.5 MB
internal-build
49.9 MB
release-cp311-macosx_arm64
36.9 MB
release-sdist
34 MB