PyPI page
Home page
Author:
Gang Liu
License:
MIT
Summary:
Deep learning packages for molecular discovery with a simple sklearn-style interface
Latest version:
0.1.7
Required dependencies:
huggingface-hub
|
joblib
|
networkx
|
numpy
|
optuna
|
rdkit
|
scikit-learn
|
scipy
|
torch
|
torch-geometric
|
tqdm
Optional dependencies:
black
|
flake8
|
isort
|
pytest
Downloads last day:
2
Downloads last week:
25
Downloads last month:
84
7-day smoothing