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MACE (mace-torch)

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library 0.3.16 ·python
verified Jun 29, 2026

MACE (Multi-Atomic Cluster Expansion) is a machine learning force field architecture based on equivariant message passing, implemented in PyTorch. Version 0.3.16 requires Python >=3.9 and is actively maintained on GitHub (ACEsuit/mace). Release cadence is irregular, approximately every 3-6 months.

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