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Author:
Edwin Mwakio, Clabe Wekesa, Patrick Okoth
License:
MIT
Summary:
Python package that calculates Lipinski descriptors, predicts pIC50, and performs docking
Latest version:
0.1.2
Required dependencies:
gemmi
|
joblib
|
numpy
|
padelpy
|
pandas
|
rdkit
|
scikit-learn
|
scipy
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