Update app.py
Browse files
app.py
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@@ -2,6 +2,7 @@ from rdkit import Chem
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from rdkit.Chem import Draw
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from transformers import pipeline
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import gradio as gr
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model_checkpoint = "FartLabs/FART_Augmented"
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classifier = pipeline("text-classification", model=model_checkpoint, top_k=None)
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@@ -17,9 +18,9 @@ def process_smiles(smiles):
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predictions = classifier(canonical_smiles)
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# Generate molecule image
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img_path = "molecule
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# Convert predictions to a friendly format
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prediction_dict = {pred["label"]: pred["score"] for pred in predictions[0]}
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from rdkit.Chem import Draw
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from transformers import pipeline
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import gradio as gr
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from interpretability import save_high_quality_png
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model_checkpoint = "FartLabs/FART_Augmented"
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classifier = pipeline("text-classification", model=model_checkpoint, top_k=None)
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predictions = classifier(canonical_smiles)
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# Generate molecule image
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img_path = "molecule"
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filepath= "molecule.png"
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save_high_quality_png(smiles, molecule)
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# Convert predictions to a friendly format
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prediction_dict = {pred["label"]: pred["score"] for pred in predictions[0]}
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