If quantum computers are to deliver benefit to biochemistry, they are not going to work in isolation. With FreeQuantum we provide, implement and demonstrate a computational pipeline for computing free energies of biomolecular systems. It is quantum-ready! arxiv.org/abs/2506.20587
arxiv.org
How to use quantum computers for biomolecular free energies
Free energy calculations are at the heart of physics-based analyses of biochemical processes. They allow us to quantify molecular recognition mechanisms, which determine a wide range of biological phe...
