Updates species dictionary path for RMG #556
Workflow file for this run
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| name: Update cache | |
| on: | |
| schedule: | |
| - cron: '0 0 */7 * *' | |
| push: | |
| branches: [ main ] | |
| pull_request: | |
| branches: [ main ] | |
| types: [opened, synchronize, reopened, ready_for_review] | |
| jobs: | |
| update_cache: | |
| runs-on: ubuntu-latest | |
| defaults: | |
| run: | |
| shell: bash -el {0} | |
| steps: | |
| # ────────── source repo ────────── | |
| - name: Checkout ARC | |
| uses: actions/checkout@v4 | |
| # ────────── AutoTST ────────── | |
| - name: Cache AutoTST | |
| id: cache-autotst | |
| uses: actions/cache@v4 | |
| with: | |
| path: AutoTST | |
| key: ${{ runner.os }}-autotst-main | |
| restore-keys: | | |
| ${{ runner.os }}-autotst- | |
| - name: Checkout AutoTST | |
| if: steps.cache-autotst.outputs.cache-hit != 'true' | |
| uses: actions/checkout@v4 | |
| with: | |
| repository: ReactionMechanismGenerator/AutoTST | |
| path: AutoTST | |
| ref: main | |
| fetch-depth: 1 | |
| # ────────── TS‑GCN ────────── | |
| - name: Cache TS-GCN | |
| id: cache-tsgcn | |
| uses: actions/cache@v4 | |
| with: | |
| path: TS-GCN | |
| key: ${{ runner.os }}-tsgcn-main | |
| restore-keys: | | |
| ${{ runner.os }}-tsgcn- | |
| - name: Checkout TS-GCN | |
| if: steps.cache-tsgcn.outputs.cache-hit != 'true' | |
| uses: actions/checkout@v4 | |
| with: | |
| repository: ReactionMechanismGenerator/TS-GCN | |
| path: TS-GCN | |
| ref: main | |
| fetch-depth: 1 | |
| # ────────── KinBot ────────── | |
| - name: Cache KinBot | |
| id: cache-kinbot | |
| uses: actions/cache@v4 | |
| with: | |
| path: KinBot | |
| key: ${{ runner.os }}-kinbot-2.0.6 | |
| restore-keys: | | |
| ${{ runner.os }}-kinbot- | |
| - name: Checkout KinBot 2.0.6 | |
| if: steps.cache-kinbot.outputs.cache-hit != 'true' | |
| uses: actions/checkout@v4 | |
| with: | |
| repository: zadorlab/KinBot | |
| path: KinBot | |
| ref: v2.0.6 | |
| fetch-depth: 1 | |
| # ────────── Env caching handled in CI workflow ────────── |