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Author:
None
License:
Apache-2.0
Summary:
Machine-learning deep molecular dynamics potentials.
Latest version:
0.2.0
Required dependencies:
blackjax
|
chex
|
cloudpickle
|
dm-haiku
|
dm-tree
|
jax
|
jax-md
|
jax-sgmc
|
jaxlib
|
jaxopt
|
networkx
|
optax
|
protobuf
|
scipy
|
sympy
|
tree_math
Optional dependencies:
breathe
|
chex
|
jax
|
jaxlib
|
matplotlib
|
mdtraj
|
myst-nb
|
orbax
|
orbax-checkpoint
|
pylint
|
pytest
|
pytest-mock
|
scikit-learn
|
sphinx
|
sphinx-autodoc-typehints
|
sphinx-book-theme
|
sphinx-remove-toctrees
|
sphinxcontrib-mermaid
|
tomli
|
tomli-w
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