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Author:
None
License:
MIT
Summary:
Deep learning models for drug discovery, quantum chemistry, and the life sciences.
Latest version:
2.8.0
Required dependencies:
joblib
|
numpy
|
pandas
|
rdkit
|
scikit-learn
|
scipy
|
sympy
Optional dependencies:
dgl
|
dgllife
|
dm-haiku
|
dqc
|
jax
|
jaxlib
|
optax
|
pylibxc2
|
pytorch-lightning
|
tensorflow
|
tensorflow-addons
|
tensorflow-probability
|
torch
|
torchvision
|
xitorch
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