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Author:
AGH ML & Chemoinformatics Group
License:
MIT
Summary:
Library for effective molecular fingerprints calculation
Latest version:
1.18.0
Required dependencies:
descriptastorus
|
e3fp
|
huggingface-hub
|
joblib
|
mordredcommunity
|
numba
|
numpy
|
pandas
|
rdkit
|
scikit-learn
|
scipy
|
tqdm
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