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Improves handling of extra particles in forces #53

Improves handling of extra particles in forces

Improves handling of extra particles in forces #53

Workflow file for this run

name: Linter
on:
push:
branches:
- "main"
pull_request:
branches:
- "main"
jobs:
linter:
name: Linter
runs-on: ${{ matrix.os }}
strategy:
matrix:
os: [ubuntu-latest]
python-version: ["3.10"]
steps:
- uses: actions/checkout@v3
- name: Additional info about the build
shell: bash
run: |
uname -a
df -h
ulimit -a
# More info on options: https://github.com/marketplace/actions/provision-with-micromamba
- uses: mamba-org/provision-with-micromamba@main
with:
environment-file: devtools/conda-envs/lint_env.yaml
environment-name: linter
channels: conda-forge,defaults
extra-specs: |
python=${{ matrix.python-version }}
- name: Install package
# conda setup requires this special shell
shell: bash -l {0}
run: |
python -m pip install . --no-deps
micromamba list
- name: Run flake8
shell: bash -l {0}
run: flake8 ufedmm/
- name: Run black
shell: bash -l {0}
run: black --diff --color ufedmm/
- name: Run isort
shell: bash -l {0}
run: isort --check-only ufedmm/