Using the Schrödinger API
At the highest level, the Schrödinger Python Application Programming Interface (API) provides a base molecular structure class and allows for programmatic interaction with Maestro and Schrödinger computational products. You can use it to automate workflows and extend the software’s core functionality.
NOTE: This documentation provides an overview of the API but does not provide the level of detail given in the class and function API documentation. It is aimed at a developer who already knows Python (or can pick it up on their own) and wants to use our API to complete a scientific project.