mcnaughtonadm commited on
Commit
bfb9104
1 Parent(s): 6f48f60

Update app.py

Browse files
Files changed (1) hide show
  1. app.py +5 -4
app.py CHANGED
@@ -62,14 +62,12 @@ with gr.Blocks(title=TITLE) as iface:
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  lines=2, placeholder="Enter your cheminformatics question..."
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  )
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- with gr.Row():
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- submit_button = gr.Button("Submit", variant="primary")
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-
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  with gr.Row(): # Row for sample questions
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  sample_questions = [
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  "What is the molecular weight of the SMILES: CCO ?",
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  "Does the SMILES: C1CCOC1 , trigger the PAINS filter?",
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- "Calculate the LogP of the smiles: CCCCCCC=C",
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  ]
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  for question in sample_questions:
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  gr.Button(question).click(
@@ -78,6 +76,9 @@ with gr.Blocks(title=TITLE) as iface:
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  prompt_input,
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  )
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  response_output = gr.Textbox(label="Agent Response")
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  gr.Markdown(CITE)
 
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  lines=2, placeholder="Enter your cheminformatics question..."
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  )
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+
 
 
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  with gr.Row(): # Row for sample questions
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  sample_questions = [
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  "What is the molecular weight of the SMILES: CCO ?",
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  "Does the SMILES: C1CCOC1 , trigger the PAINS filter?",
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+ "Identify the molecular weight, logP, and Topological Polar Surface Area (TPSA) of the molecule with the SMILES notation CC(=O)NC1=CC=C(O)C=C1",
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  ]
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  for question in sample_questions:
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  gr.Button(question).click(
 
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  prompt_input,
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  )
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+ with gr.Row():
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+ submit_button = gr.Button("Submit", variant="primary")
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+
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  response_output = gr.Textbox(label="Agent Response")
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  gr.Markdown(CITE)