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Author:
None
Summary:
Differentiable, Hardware Accelerated, Molecular Dynamics
Latest version:
0.2.29
Required dependencies:
absl-py
|
e3nn-jax
|
einops
|
flax
|
frozendict
|
jax
|
jaxlib
|
jraph
|
ml-collections
|
numpy
|
optax
|
pymatgen
Optional dependencies:
openmm
|
openmmforcefields
|
parmed
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