Version 1.1 #182
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Version 1.1 #182
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Also add web app code for simple gradio app. Refine requirements.txt/environment.yml. Automatically download models if not present.
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Update February 2024: We have released DiffDock-L, a new version of DiffDock that provides a significant improvement in performance and generalization capacity (see the description of the new version in our new paper (forthcoming on arxiv)). By default the repository now runs the new model, please use GitHub commit history to run the original DiffDock model. Further we now provide instructions for Docker and to set up your own local UI interface.
You can also try out the model on Hugging Face Spaces.