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Simon Duerr commited on
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add gitlfs

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Files changed (2) hide show
  1. .gitattributes +17 -6
  2. README.md +12 -0
.gitattributes CHANGED
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  *.ipynb linguist-vendored=false
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  *.ipynb linguist-detectable=false
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-
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  /jupyter_notebooks linguist-vendored=false
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-
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  jupyter_notebooks/** linguist-vendored
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-
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  jupyter_notebooks/** linguist-vendored=false
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-
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-
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  jupyter_notebooks/* linguist-vendored
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- jupyter_notebooks/* linguist-vendored=false
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
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  *.ipynb linguist-vendored=false
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  *.ipynb linguist-detectable=false
 
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  /jupyter_notebooks linguist-vendored=false
 
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  jupyter_notebooks/** linguist-vendored
 
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  jupyter_notebooks/** linguist-vendored=false
 
 
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  jupyter_notebooks/* linguist-vendored
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+ jupyter_notebooks/* linguist-vendored=false
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+ data/esm2_output_back/1a46_protein_processed.pdb_chain_1.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output/1a46_protein_processed0t6cxvmshf54nq5e.pdb_chain_0.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output/1a46_protein_processedhoiape3r6cbddini.pdb_chain_0.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output/1a46_protein_processedhoiape3r6cbddini.pdb_chain_1.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output/1a46_protein_processeds5c7cs3aj6rvbhy_.pdb_chain_0.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output/1a46_protein_processedtyfuvx9z8y4_86ft.pdb_chain_0.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output_back/1a46_protein_processed.pdb_chain_0.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output/1a46_protein_processed.pdb_chain_0.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output_back/1cbr_protein.pdb_chain_1.pt filter=lfs diff=lfs merge=lfs -text
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+ workdir/paper_confidence_model/best_model_epoch75.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output/1a46_protein_processeds5c7cs3aj6rvbhy_.pdb_chain_1.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output_back/1cbr_protein.pdb_chain_0.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output/1a46_protein_processed0t6cxvmshf54nq5e.pdb_chain_1.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output/1a46_protein_processed.pdb_chain_1.pt filter=lfs diff=lfs merge=lfs -text
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+ data/esm2_output/1a46_protein_processedtyfuvx9z8y4_86ft.pdb_chain_1.pt filter=lfs diff=lfs merge=lfs -text
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+ workdir/paper_score_model/best_ema_inference_epoch_model.pt filter=lfs diff=lfs merge=lfs -text
README.md CHANGED
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  # DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
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  ### [Paper on arXiv](https://arxiv.org/abs/2210.01776)
 
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+ ---
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+ title: Diffdock
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+ emoji: 🐠
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+ colorFrom: indigo
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+ colorTo: pink
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+ sdk: gradio
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+ sdk_version: 3.4.1
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+ app_file: app.py
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+ pinned: false
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+ license: mit
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+ ---
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+
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  # DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking
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  ### [Paper on arXiv](https://arxiv.org/abs/2210.01776)