torch-pgn
Proximity Graph Networks: Predicting ligand affinity with Message Passing Neural Networks
Installation
In a virtualenv (see these instructions if you need to create one):
pip3 install torch-pgn
Releases
| Version | Released | Bullseye Python 3.9 |
Bookworm Python 3.11 |
Files |
|---|---|---|---|---|
| 0.1.3 | 2024-09-10 | |||
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| 0.1.2 | 2024-06-21 | |||
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| 0.1.1 | 2024-06-21 | |||
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