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Openff Evaluator ⭐ 47

A physical property evaluation toolkit from the Open Forcefield Consortium.

Pygromostools ⭐ 15

This package is a python library with tools for the Molecular Simulation - Software Gromos. It allows you to easily set up, manage and analyze simulations in python.

The peleffy (PELE Force Field Yielder) is a Python package that builds PELE-compatible force field templates.

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