From d4a2a0ee02ed4c913ee20ccbf883e782bbc9e5c4 Mon Sep 17 00:00:00 2001 From: Max Imakaev Date: Wed, 16 Apr 2025 16:34:28 -0600 Subject: [PATCH] Update pythonapp.yml --- .github/workflows/pythonapp.yml | 10 +++++----- 1 file changed, 5 insertions(+), 5 deletions(-) diff --git a/.github/workflows/pythonapp.yml b/.github/workflows/pythonapp.yml index dd32687..3f7c284 100644 --- a/.github/workflows/pythonapp.yml +++ b/.github/workflows/pythonapp.yml @@ -8,13 +8,13 @@ jobs: runs-on: ubuntu-latest steps: - uses: actions/checkout@v2 - - name: Set up Python 3.9 + - name: Set up Python 3.12 uses: actions/setup-python@v1 with: - python-version: 3.9 + python-version: 3.12 - uses: s-weigand/setup-conda@v1 with: - python-version: 3.9 + python-version: 3.12 activate-conda: true - run: conda --version - run: which python @@ -22,9 +22,9 @@ jobs: - run: ls -la - name: Install dependencies run: | - sudo apt-get install build-essential - conda install -c conda-forge openmm + sudo apt-get install build-essential conda install pip + pip install openmm pip install cython pip install -r requirements.txt pip install -e .