The OpenEye Python Cookbook is a collection of solutions and practical examples for solving cheminformatics and molecule modeling problems using various OpenEye toolkits.
To install OpenEye’s Python package, please see instructions in the Getting Started with OpenEye Python section of the main OpenEye documentation.
We expect that you are familiar with at least some Python and have used OpenEye toolkits before. The main purpose of this documentation is to illustrate that by combining various OpenEye toolkits you can solve a wide range of cheminformatics and molecular modeling problems.
Outline of Recipes¶
Each recipe in this documentation is divided into the following sections:
Problem - brief description of the problem you are trying to solve
Ingredients - the list of the OpenEye toolkits you need to solve this problem
Difficulty Level - each recipe is put into one of the following categories:
Download - most recipes provide complete python code that you can download.
Solution - code snippet(s) with detailed explanations about how to solve the problem
Usage - example of utilizing the provided Python script
Discussion - further discussion and additional code snippet(s) to solve similar problems
See Also - links and references to other OpenEye toolkit manuals