Installation

mltsa targets Python 3.10 and newer.

Base install

For local development inside this repository:

pip install -e .

For a test-ready environment:

pip install -e ".[test]"

MD extras

The MD workflow relies on optional dependencies such as mdtraj and matplotlib.

pip install -e ".[test,md]"

Notes

  • scikit-learn and torch are regular package dependencies.

  • mdtraj can require platform-specific binary wheels or local build tools.

  • The package CLI is available through mltsa and mltsa-md after installation.