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Merge pull request #93 from duerrsimon/patch-1
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Remove hyperparameter notice
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gcorso authored Mar 27, 2023
2 parents f135e3b + 23e1dba commit 3c3c728
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3 changes: 2 additions & 1 deletion README.md
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Expand Up @@ -12,8 +12,9 @@ If you have any question, feel free to open an issue or reach out to us: [gcorso
The repository also contains all the scripts to run the baselines and generate the figures.
Additionally, there are visualization videos in `visualizations`.

You might also be interested in this awesome [interactive online tool](https://huggingface.co/spaces/simonduerr/diffdock) by Simon Duerr on Hugging Face for running DiffDock and visualising the predicted structures on your browser, however note that this does not use the optimal hyperparameters for the reverse diffusion which instead are provided below. Instead, Brian Naughton made a [Google Colab notebook](https://colab.research.google.com/drive/1nvCyQkbO-TwXZKJ0RCShVEym1aFWxlkX) to run DiffDock.
You might also be interested in this awesome [interactive online tool](https://huggingface.co/spaces/simonduerr/diffdock) by Simon Duerr on Hugging Face for running DiffDock and visualising the predicted structures on your browser. There is also a [Google Colab notebook](https://colab.research.google.com/drive/1nvCyQkbO-TwXZKJ0RCShVEym1aFWxlkX) to run DiffDock by Brian Naughton.

[![Open in Spaces](https://huggingface.co/datasets/huggingface/badges/raw/main/open-in-hf-spaces-lg-dark.svg)](https://huggingface.co/spaces/simonduerr/diffdock)


# Dataset
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