Update fingerprint invocation and schema accordingly #287
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| on: | |
| pull_request: { } | |
| env: | |
| REGISTRY: ghcr.io | |
| REPO_LOWER: rdkit-rs/cheminee | |
| jobs: | |
| test: | |
| env: | |
| ARCH: amd64 | |
| runs-on: buildjet-16vcpu-ubuntu-2204 | |
| permissions: | |
| contents: read | |
| packages: write | |
| steps: | |
| - name: Git checkout | |
| uses: actions/checkout@v2 | |
| - name: Run sccache-cache | |
| uses: mozilla/sccache-action@eaed7fb9f8fb32adea8bd40d7f276f312de9beaf | |
| with: | |
| version: "v0.4.0-pre.10" | |
| - name: Run sccache stat for check | |
| shell: bash | |
| run: ${SCCACHE_PATH} --show-stats | |
| - name: Install dependencies | |
| run: | | |
| sudo apt-get update | |
| sudo apt-get install -y build-essential libssl-dev libboost-iostreams-dev libboost-serialization-dev pkg-config curl tar | |
| - name: Install RDKit | |
| run: | | |
| cd /tmp | |
| if [ $(dpkg --print-architecture) = "amd64" ]; then | |
| curl -O https://rdkit-rs-debian.s3.eu-central-1.amazonaws.com/rdkit_2024_03_3_ubuntu_14_04_amd64.tar.gz | |
| sudo tar xf rdkit_2024_03_3_ubuntu_14_04_amd64.tar.gz | |
| else | |
| curl -O https://rdkit-rs-debian.s3.eu-central-1.amazonaws.com/rdkit_2024_03_3_ubuntu_14_04_arm64.tar.gz | |
| sudo tar xf rdkit_2024_03_3_ubuntu_14_04_arm64.tar.gz | |
| fi | |
| sudo mv /tmp/rdkit-Release_2024_03_3/Code /usr/local/include/rdkit | |
| sudo mv /tmp/rdkit-Release_2024_03_3/build/lib/* /usr/lib/ | |
| - name: Install latest stable | |
| uses: actions-rs/toolchain@v1 | |
| with: | |
| toolchain: stable | |
| override: true | |
| components: rustfmt, clippy | |
| - name: Cargo Test | |
| run: RUST_WRAPPER=$SCCACHE_PATH cargo test |