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app.py
CHANGED
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@@ -30,7 +30,7 @@ def generate_polymer(CH4, CO2, H2, N2, O2, guidance_scale):
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try:
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# Generate a random SMILES string (this is a placeholder)
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generated_molecule = generate_random_smiles()
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model.generate(properties, device)
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mol = Chem.MolFromSmiles(generated_molecule)
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if mol is not None:
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try:
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# Generate a random SMILES string (this is a placeholder)
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generated_molecule = generate_random_smiles()
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# model.generate(properties, device)
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mol = Chem.MolFromSmiles(generated_molecule)
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if mol is not None:
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