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mir-group/nequip
mir-group/nequip PublicNequIP is a code for building E(3)-equivariant interatomic potentials
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mir-group/allegro
mir-group/allegro PublicAllegro is an open-source code for building highly scalable and accurate equivariant deep learning interatomic potentials
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jax-md/jax-md
jax-md/jax-md PublicDifferentiable, Hardware Accelerated, Molecular Dynamics
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