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Update app.py
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app.py
CHANGED
@@ -97,7 +97,7 @@ with st.sidebar:
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molecule_num_input = st.number_input('Number of molecules to generate', min_value=1, max_value=100_000, value=1000, step=1)
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seed_input = st.number_input("Input an RNG seed for reproducibiliy", min_value=0, value=
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submitted = st.form_submit_button("Start Computing")
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@@ -117,9 +117,9 @@ if submitted:
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with st.expander("Expand to see scores"):
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st.
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st.
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st.
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with open(f'experiments/inference/{model_name}/inference_drugs.txt') as f:
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inference_drugs = f.read()
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molecule_num_input = st.number_input('Number of molecules to generate', min_value=1, max_value=100_000, value=1000, step=1)
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seed_input = st.number_input("Input an RNG seed for reproducibiliy", min_value=0, value=42, step=1)
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submitted = st.form_submit_button("Start Computing")
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with st.expander("Expand to see scores"):
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st.success(f"Validity: {results['fraction_valid']}")
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st.success(f"Uniqueness: {results['uniqueness']}")
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st.success(f"Novelty: {results['novelty']}")
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with open(f'experiments/inference/{model_name}/inference_drugs.txt') as f:
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inference_drugs = f.read()
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