PyPI page
Author:
Francho Nerín Fonz
License:
GPL-3.0
Summary:
Machine learning allosteric pocket prediction, pathway tracing, and 3D visualization
Latest version:
1.1.0
Required dependencies:
biopython
|
biotite
|
click
|
colabfold
|
joblib
|
lightgbm
|
melodia-py
|
networkx
|
nglview
|
numba
|
numpy
|
openmm
|
pandas
|
pdbecif
|
pdbfixer
|
peewee
|
prody
|
pyarrow
|
requests
|
scikit-learn
|
scipy
|
tqdm
Optional dependencies:
alphafold-colabfold
|
bandit
|
black
|
flake8
|
ipymolstar
|
mypy
|
pre-commit
|
pytest
|
pytest-cov
|
xgboost
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