Saicharan commited on
Commit
0a798d8
1 Parent(s): 0b2b170

SA score added

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Files changed (1) hide show
  1. molgenevalmetric.py +1 -1
molgenevalmetric.py CHANGED
@@ -565,7 +565,7 @@ class molgenevalmetric(evaluate.Metric):
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  # metrics['FCD'] = fcd_metric(gen = gensmi, train = trainsmi)
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  # metrics['Oracles'] = oracles(gen = gensmi, train = trainsmi)
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- print('computing')
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  metrics['SA'] = average_sascore(gen=gensmi)
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  metrics['SCS'] = synthetic_complexity_score(gen=gensmi)
 
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  # metrics['FCD'] = fcd_metric(gen = gensmi, train = trainsmi)
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  # metrics['Oracles'] = oracles(gen = gensmi, train = trainsmi)
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+ # print('computing')
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  metrics['SA'] = average_sascore(gen=gensmi)
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  metrics['SCS'] = synthetic_complexity_score(gen=gensmi)