Python version of the amazing Reaction Mechanism Generator (RMG).
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Updated
Sep 6, 2024 - Python
Python version of the amazing Reaction Mechanism Generator (RMG).
The ATOM Modeling PipeLine (AMPL) is an open-source, modular, extensible software pipeline for building and sharing models to advance in silico drug discovery.
Quantum Particle-in-a-Sandbox
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