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Quantum Approximate Optimisation Algorithm for Protein Sidechain Packing

Stewart, Sebastian O. M. et al.
arXiv (All) · Papers
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quantum-physics
Sidechain packing is a critical stage in protein folding, with direct implications for structure-based drug discovery. Google DeepMind's tool, AlphaFold2, predicts protein backbone reliably but sidechain positioning less accurately. Recovering the lowest-energy rotamer assignment over a fixed backbo
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