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RMeli/gnina-torch

sourceHugging Facemitupdated 4y agoView on Hugging Face

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App README

GninaTorch @ Hugginface

Scoring protein-ligand complexes using Gnina's scoring function via gnina-torch on Hugging Face Spaces.

https://huggingface.co/spaces/RMeli/gnina-torch

Notes

Hugging Face Spaces work as git repositories. To keep everything on GitHub but publish on Hugging Face, add the Hugging Face Space repository as a remote repository:

bash

git remote add hf https://huggingface.co/spaces/RMeli/gnina-torch

Acknowledgements

—@duerrsimon for Visualize proteins on Hugging Face Spaces