psdi-data-conversion 0.0.31__tar.gz → 0.0.32__tar.gz
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- psdi_data_conversion-0.0.32/.github/workflows/ci-deploy-production.yml +61 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/PKG-INFO +1 -1
- psdi_data_conversion-0.0.31/.github/workflows/ci-deploy-production.yml +0 -48
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/ci-cron.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/ci-feature.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/ci-main.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/ci-pr.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/ci-rc-hotfix.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/ci-release.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/job-anchore-scan.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/job-container-push.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/job-deploy-azure.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/job-deploy-k8s.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/job-open-pull-request.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/job-publish-doc.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/job-tag.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/job-test-gui.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/job-test-python.yml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.gitignore +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/CHANGELOG.md +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/CONTRIBUTING.md +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/LICENSE +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/README.md +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/__init__.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/app.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/bin/LICENSE_ATOMSK +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/bin/LICENSE_C2X +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/bin/linux/atomsk +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/bin/linux/c2x +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/bin/mac/atomsk +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/bin/mac/c2x +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/constants.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/converter.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/converters/__init__.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/converters/atomsk.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/converters/base.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/converters/c2x.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/converters/openbabel.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/database.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/dist.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/file_io.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/log_utility.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/main.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/scripts/atomsk.sh +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/scripts/c2x.sh +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/security.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/accessibility.htm +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/convert.htm +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/convertato.htm +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/convertc2x.htm +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/documentation.htm +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/download.htm +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/feedback.htm +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/header-links.html +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/index-versions/header-links.html +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/index-versions/psdi-common-footer.html +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/index-versions/psdi-common-header.html +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/psdi-common-footer.html +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/psdi-common-header.html +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/content/report.htm +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/data/data.json +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/colormode-toggle-dm.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/colormode-toggle-lm.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/psdi-icon-dark.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/psdi-icon-light.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/psdi-logo-darktext-simple.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/psdi-logo-darktext.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/psdi-logo-lighttext-simple.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/psdi-logo-lighttext.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-bluesky-black.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-bluesky-white.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-instagram-black.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-instagram-white.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-linkedin-black.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-linkedin-white.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-mastodon-black.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-mastodon-white.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-x-black.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-x-white.svg +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-youtube-black.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/social-logo-youtube-white.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/ukri-epsr-logo-darktext.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/ukri-epsr-logo-lighttext.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/ukri-logo-darktext.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/img/ukri-logo-lighttext.png +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/accessibility.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/common.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/convert.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/convert_common.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/convertato.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/convertc2x.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/data.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/format.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/load_accessibility.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/psdi-common.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/javascript/report.js +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/styles/format.css +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/static/styles/psdi-common.css +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/templates/index.htm +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/testing/__init__.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/testing/constants.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/testing/conversion_callbacks.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/testing/conversion_test_specs.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/psdi_data_conversion/testing/utils.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/pyproject.toml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/run_local.sh +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/scripts/setup_bin.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/1ARJ.mmcif +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/1NE6.mmcif +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/5a9z-assembly1.cif +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/Fapatite.ins +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/aceticacid.mol +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/benzyne.molden +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/caffeine-smi.tar +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/caffeine-smi.tar.gz +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/caffeine-smi.zip +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/caffeine.inchi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/ch3cl-esp.cub +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/cyclopropane_err.mol +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/ethanol.xyz +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/fullRhinovirus.pdb +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/hemoglobin.pdb +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/nacl.cif +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/nacl.mol +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/aceticacid.log.txt +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/aceticacid.mol2 +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine-2D-fastest.xyz +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine-3D-best.xyz +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine-ia-okx-oof4.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine-ia-okx-oof4l5.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine-ia-okx.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine-ia-ox.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine-ia.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine-no-flags.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine.xyz +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine_a_in.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine_a_in_kx_f4_l5_out.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine_a_in_kx_f4_out.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine_a_in_kx_out.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/caffeine_a_in_x_out.smi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/error_Fapatite_ins_to_cml_OB +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/error_cyclopropane_mol_to_xyz_c2x +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/error_nacl_mol_to_xyz_atomsk +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/hemoglobin_Atomsk.xyz +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/hemoglobin_c2x.xyz +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/nacl.log +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/nacl.mol +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/quartz_OB.cif +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/quartz_OB.log.txt +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/quartz_atomsk.cif +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/quartz_atomsk.log.txt +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/standard_test.inchi +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/xyz_files-mol.zip +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/output/xyz_files.log.txt +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/periodic_dmol3.outmol +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/quartz.xyz +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/quartz_err.xyz +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/test_data/standard_test.cdxml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/tests/cli_test.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/tests/converter_test.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/tests/database_test.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/tests/dist_test.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/tests/file_io_test.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/tests/logging_test.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/tests/security_test.py +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/tests/selenium/files/standard_test.cdxml +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/tests/selenium/run.sh +0 -0
- {psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/tests/selenium/selenium_tests.py +0 -0
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# Workflow for manually triggering deployment of latest release version to the production environment
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# It is intended that this workflow be manually triggered after the 'ci-release.yml' job has been shown
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# to successfully deploy the latest release version to the staging cluster.
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+
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# To be more specific, this workflow deploys the container in the GitHub Container Registry namespace for this
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# repo whose tag corresponds to the highest version number, while only considering tags of the form 'v*.*.*',
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# where '*' signify non-negative integers.
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name: CI - Deploy to production cluster
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run-name: CI - Deploy to production cluster
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on:
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workflow_dispatch:
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jobs:
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check-branch:
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# Check that this job is being run on the release branch
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runs-on: psdi-uk-runners
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steps:
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- name: Check branch (success)
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if: github.ref == 'refs/heads/release'
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run: echo "Success - this is being run on the 'release' branch"
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- name: Check branch (failure)
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if: github.ref != 'refs/heads/release'
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run: |
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echo "ERROR: This workflow can only be run on the 'release' branch"
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false # Command that always fails, to signal the job to fail
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get-latest-release-tag:
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# run on our self hosted github runners enabling access to STFC infrastructure
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runs-on: psdi-uk-runners
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needs: check-branch
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outputs:
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tag: ${{ steps.get-tag.outputs.TARGET_TAG }}
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steps:
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- uses: actions/checkout@v4
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- name: Get latest tag in the relase branch
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id: get-tag
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run: |
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# Use GitHub CR API to get list of all tags
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GHCR_TOKEN=$(echo -n "${{ secrets.GITHUB_TOKEN }}" | base64 -w 0)
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echo "Requesting list of tags from GitHub CR for repo..."
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RESPONSE=$(curl -s -H "Authorization: Bearer $GHCR_TOKEN" "https://ghcr.io/v2/psdi-uk/psdi-data-conversion/data-conversion/tags/list")
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echo "Response recieved = $RESPONSE"
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# Extract only the tags corresponding to releases, i.e. of the form 'v*.*.*'
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echo "Extracting tags from response..."
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TAGS=$(echo "$RESPONSE" | jq -r '."tags"[]' | grep -E '^v[0-9]+\.[0-9]+\.[0-9]+')
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echo "Extracted tags = $TAGS"
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# Find the highest version number
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TARGET_TAG=$(echo "$TAGS" | sort -V | tail -n 1)
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echo "TARGET_TAG=$TARGET_TAG" >> "$GITHUB_OUTPUT"
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echo "Highest version tag found to be = $TARGET_TAG"
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# Deploy container with tag to production environment
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deploy-stfc-production-k8s:
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needs: get-latest-release-tag
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uses: ./.github/workflows/job-deploy-k8s.yml # use the callable deploy job
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secrets: inherit # pass all secrets for the environment
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with:
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container_tag: ${{ needs.get-latest-release-tag.outputs.tag }}
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environment: production
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@@ -1,6 +1,6 @@
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Metadata-Version: 2.1
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Name: psdi_data_conversion
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Version: 0.0.
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Version: 0.0.32
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Summary: Chemistry file format conversion service, provided by PSDI
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Project-URL: Homepage, https://psdidev2.azurewebsites.net/
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Project-URL: Documentation, https://psdi-uk.github.io/psdi-data-conversion/
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@@ -1,48 +0,0 @@
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1
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# Workflow for manually triggering deployment of latest release version to the production environment
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2
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-
|
3
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-
# It is intended that this workflow be manually triggered after the 'ci-release.yml' job has been shown
|
4
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-
# to successfully deploy the latest release version to the staging cluster.
|
5
|
-
|
6
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-
# To be more specific, this workflow deploys the container in the GitHub Container Registry namespace for this
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-
# repo whose tag corresponds to the highest version number, while only considering tags of the form 'v*.*.*',
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# where '*' signify non-negative integers.
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-
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name: CI - Deploy to production cluster
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run-name: CI - Deploy to production cluster
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on:
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workflow_dispatch:
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-
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15
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-
jobs:
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-
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get-latest-release-tag:
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# run on our self hosted github runners enabling access to STFC infrastructure
|
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runs-on: psdi-uk-runners
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20
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-
outputs:
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tag: ${{ steps.get-tag.outputs.TARGET_TAG }}
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steps:
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- uses: actions/checkout@v4
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- name: Get latest tag in the relase branch
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id: get-tag
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run: |
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# Use GitHub CR API to get list of all tags
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GHCR_TOKEN=$(echo -n "${{ secrets.GITHUB_TOKEN }}" | base64 -w 0)
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echo "Requesting list of tags from GitHub CR for repo..."
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RESPONSE=$(curl -s -H "Authorization: Bearer $GHCR_TOKEN" "https://ghcr.io/v2/psdi-uk/psdi-data-conversion/data-conversion/tags/list")
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echo "Response recieved = $RESPONSE"
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# Extract only the tags corresponding to releases, i.e. of the form 'v*.*.*'
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-
echo "Extracting tags from response..."
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TAGS=$(echo "$RESPONSE" | jq -r '."tags"[]' | grep -E '^v[0-9]+\.[0-9]+\.[0-9]+')
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echo "Extracted tags = $TAGS"
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# Find the highest version number
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TARGET_TAG=$(echo "$TAGS" | sort -V | tail -n 1)
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echo "TARGET_TAG=$TARGET_TAG" >> "$GITHUB_OUTPUT"
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echo "Highest version tag found to be = $TARGET_TAG"
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-
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# Deploy container with tag to production environment
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deploy-stfc-production-k8s:
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needs: get-latest-release-tag
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uses: ./.github/workflows/job-deploy-k8s.yml # use the callable deploy job
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secrets: inherit # pass all secrets for the environment
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with:
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container_tag: ${{ needs.get-latest-release-tag.outputs.tag }}
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environment: production
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{psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/ci-feature.yml
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{psdi_data_conversion-0.0.31 → psdi_data_conversion-0.0.32}/.github/workflows/ci-rc-hotfix.yml
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