=================================== Welcome to AniSOAP's documentation! =================================== **AniSOAP** is a Python library for creating descriptors of chemical systems suitable for machine learning use. This project aims to extend the popular Smooth Overlap of Atomic Positions (SOAP) descriptors to coarse-grained systems consisting of aspherical particles with anisotropic interactions. .. note:: This project is under active development. .. note:: AniSOAP documentation is a work in progress; please contact us with questions not yet addressed here. .. toctree:: :maxdepth: 2 :caption: Contents: installation getting_started auto_examples/index api