SQSnobFit

Plugin class: Optimizer

Acquisition

This plugin is available for download at https://github.com/RxnRover/plugin_sqsnobfit.

Description

This plugin allows Rxn Rover to connect with an instance of SQSnobFit, a Python reimplementation of the SNOBFIT blackbox optimization algorithm. A Python program is provided with the plugin to launch an instance of SQSnobFit for use with this plugin. This program uses a modified objective function with built-in communication capabilities. The SQSnobFit algorithm, along with other aspects of the program, can be configured by specifying a configuration file (example files are provided).