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Author

Chenyu Wu

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Review Jul 2026

Hybrid ML/MM Simulations for Computational Enzymology: Recent Advances and Challenges.

This Perspective surveys the central methodological challenges in developing ML/MM frameworks, including the generation of high-quality reference data and the treatment of multiscale coupling.

Xinhu Sha, Chenyu Wu, Daiqian Xie et al. · 0 citations

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