.. _API: ############# API Reference ############# YANK's API allows users to setup and run their own simulations in programmatic ways. If you would rather run YANK with YAML input files, please see the command line interface and the YAML options. .. toctree:: :maxdepth: 1 analyze_api experiment_api mpi_api pipeline_api repex_api restraints_api utils_api yank_api