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1 parent f4b5eff commit 3549d8cCopy full SHA for 3549d8c
README.md
@@ -90,7 +90,7 @@ smiles_list, property_np_array = load_qm9(local_dir='torchmol_data')
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# len(smiles_list): 133885
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# Property array shape: (133885, 1)
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-# load_qm9 returns the target "gas" by default, but you can adjust it by passing new target_cols
+# load_qm9 returns the target "gap" by default, but you can adjust it by passing new target_cols
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target_cols = ['homo', 'lumo', 'gap']
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smiles_list, property_np_array = load_qm9(local_dir='torchmol_data', target_cols=target_cols)
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```
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