- version bump #23
Workflow file for this run
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name: Small Benchmarks | |
on: | |
push: | |
paths: | |
- 'pysipfenn/descriptorDefinitions/**' | |
- '.github/workflows/benchmarks.yaml' | |
workflow_dispatch: | |
jobs: | |
benchmark: | |
strategy: | |
matrix: | |
python-version: ["3.9", "3.10", "3.11"] | |
fail-fast: false | |
runs-on: ubuntu-22.04 | |
steps: | |
- uses: actions/checkout@v4 | |
- name: Set up Python ${{ matrix.python-version }} | |
uses: actions/setup-python@v5 | |
with: | |
python-version: ${{ matrix.python-version }} | |
cache: 'pip' | |
cache-dependency-path: 'pyproject.toml' | |
- name: Install dependencies | |
run: | | |
python -m pip install --upgrade pip | |
python -m pip install --upgrade setuptools | |
python -m pip install wheel flask | |
python -m pip install -e . | |
- name: Benchmark KS2022 | |
run: python -c "from pysipfenn.descriptorDefinitions import KS2022; KS2022.profile(test='JVASP-10001', nRuns=100); KS2022.profile(test='diluteNiAlloy', nRuns=100)" | |
- name: Benchmark Ward2017 | |
run: python -c "from pysipfenn.descriptorDefinitions import Ward2017; Ward2017.profile(test='JVASP-10001', nRuns=100); Ward2017.profile(test='diluteNiAlloy', nRuns=100)" | |
- name: Benchmark KS2022 dilute featurizer | |
run: python -c "from pysipfenn.descriptorDefinitions import KS2022_dilute; KS2022_dilute.profile(test='diluteNiAlloy', nRuns=250)" | |