# Use of Nonequilibrium Work Methods to Compute Free Energy Differences Between Molecular Mechanical and Quantum Mechanical Representations of Molecular Systems

> Research article (The Journal of Physical Chemistry Letters, 2015) · cited 90× · AI/ML

**Wikidata**: [openalex:W2338036129](https://www.wikidata.org/wiki/openalex:W2338036129)  
**Source**: https://4ort.xyz/entity/use-of-nonequilibrium-work-methods-to-compute-free-energy-differences-between-molecular-mechanical-and-quantum-mechanica