simonduerr commited on
Commit
7444111
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verified ·
1 Parent(s): d18697e

Update inference_app.py

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Files changed (1) hide show
  1. inference_app.py +3 -2
inference_app.py CHANGED
@@ -133,9 +133,10 @@ def predict (input_sequence, input_ligand,input_msa, input_protein):
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  with gr.Blocks() as app:
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- gr.Markdown("# Template for inference")
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- gr.Markdown("Title, description, and other information about the model")
 
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  with gr.Row():
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  input_sequence = gr.Textbox(lines=3, label="Input Protein sequence (FASTA)")
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  input_ligand = gr.Textbox(lines=3, label="Input ligand SMILES")
 
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  with gr.Blocks() as app:
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+ gr.Markdown("# Strong Docking Baseline")
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+ gr.Markdown("Using the strong docking baseline from inductive bio described in their [blog post](https://www.inductive.bio/blog/strong-baseline-for-alphafold-3-docking)")
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+ gr.Markdown("Note that in the original implementation the binding site is defined by the original ligand (redocking), here we use a bounding box of the protein for the docking (blind docking).")
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  with gr.Row():
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  input_sequence = gr.Textbox(lines=3, label="Input Protein sequence (FASTA)")
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  input_ligand = gr.Textbox(lines=3, label="Input ligand SMILES")