piwheels

pbcnet

PBCNet: Deep learning framework for protein-ligand binding affinity prediction

Installation

In a virtualenv (see these instructions if you need to create one):

pip3 install pbcnet

Dependencies

• scikit-learn
• pydantic
• rdkit-pypi
• scipy
• pyyaml
• torch
• torchaudio
• requests
• dgl
• matplotlib
• torchvision
• charset-normalizer
• networkx
• packaging
• biopython
• numpy
• psutil
• tqdm
• pandas

Releases

Version	Released	Bullseye Python 3.9	Bookworm Python 3.11	Files
2.0.9	2025-07-07
pbcnet-2.0.9-py3-none-any.whl (3 MB)

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