Getting Started

This page details how to get started with lpath.

  1. Clone the repository from GitHub:

    git clone https://github.com/jeremyleung521/lpath
    
  2. In the cloned directory, install the program with pip. Specify westpa if you are analyzing a weighted ensemble simulation. Specify dev if you need to install all dependencies:

    cd lpath
    pip install -e .  # for essentials OR
    pip install -e .[westpa]  # with WESTPA OR
    pip install -e .[dev]  # all dependencies
    
  3. Run all or parts of the program. See Usage for more information.