Update predict_perovskite_stability.py
Browse files
predict_perovskite_stability.py
CHANGED
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@@ -47,7 +47,7 @@ def process_data(comp_list):
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X, y = ElementalFeatureGenerator(df_test['Material composition'],
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feature_types=['composition_avg', 'arithmetic_avg', 'max', 'min',
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'difference'], remove_constant_columns=False).evaluate(X=X, y=y, savepath=os.getcwd(), make_new_dir=False)
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df_test = pd.concat([df_test, X], axis=1)
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X, y = ElementalFeatureGenerator(df_test['Material composition'],
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feature_types=['composition_avg', 'arithmetic_avg', 'max', 'min',
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'difference'], remove_constant_columns=False).evaluate(X=X, y=y, savepath=os.getcwd(), make_new_dir=False, write_to_file=False)
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df_test = pd.concat([df_test, X], axis=1)
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