xyz-py 5.20.0

A package for manipulating xyz files and chemical structures

xyz-py

xyz-py is a python module for working with and manipulating chemical structures.

Installation

For convenience, xyz-py is available on PyPI and so can be installed using pip

pip install xyz-py

Functionality

To use the functions included in xyz-py, first import it into your python file

import xyz_py as xyzp

and then call them as

xyzp.function_name(arguments)

To find information on any of the functions included in xyz-py, use the help command from within a python environment, e.g.

help(xyzp.function_name)

or visit the documentation.