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AIdsorb is a Python package for deep learning on molecular point clouds.

This package aims to provide a simple, easy-to-use and reproduce interface for:

  • 📥 Creating molecular point clouds

  • 🤖 Training DL algorithms on molecular point clouds

Caution

This is not the official repository and it is not guaranteed to be maintained. If you want to star, please star the official one.

For the official 👉 https://github.com/adosar/aidsorb.

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Python package for deep learning on molecular point clouds.

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  • Python 100.0%