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Update trainer.py
Browse files- trainer.py +2 -2
trainer.py
CHANGED
@@ -917,8 +917,8 @@ class Trainer(object):
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"Runtime (seconds)": round(et, 2),
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"Validity": f"{fraction_valid(metric_calc_dr)*100:.2f}%",
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"Uniqueness": f"{fraction_unique(metric_calc_dr)*100:.2f}%",
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"Novelty Train": f"{novelty(metric_calc_dr, smiles_train)*100:.2f}%",
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"Novelty Test": f"{novelty(metric_calc_dr, smiles_test)*100:.2f}%"
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}
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# print("Validity: ", fraction_valid(metric_calc_dr), "\n")
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# print("Uniqueness: ", fraction_unique(metric_calc_dr), "\n")
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"Runtime (seconds)": round(et, 2),
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"Validity": f"{fraction_valid(metric_calc_dr)*100:.2f}%",
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"Uniqueness": f"{fraction_unique(metric_calc_dr)*100:.2f}%",
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"Novelty (Train)": f"{novelty(metric_calc_dr, smiles_train)*100:.2f}%",
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"Novelty (Test)": f"{novelty(metric_calc_dr, smiles_test)*100:.2f}%"
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}
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# print("Validity: ", fraction_valid(metric_calc_dr), "\n")
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# print("Uniqueness: ", fraction_unique(metric_calc_dr), "\n")
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