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deepmodeling / DMFF

DMFF (Differentiable Molecular Force Field) is a Jax-based python package that provides a full differentiable implementation of molecular force field models.
GNU Lesser General Public License v3.0
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Update classical.py #166

Closed Ethan-Norch closed 4 months ago

Ethan-Norch commented 4 months ago

A little debug in classical.py file