Update Preprocessing Script.py

Preprocessing Script.py

@@ -161,7 +161,7 @@ for id, alert in problems:
 #5. Select columns and rename the dataset
 
 Long2023.rename(columns={'X': 'new SMILES', 'Y': 'Label'}, inplace=True)
-Long2023[['new SMILES', 'Label']].to_csv('Long2023.csv', index=False)
+HematoxLong2023 = Long2023[['new SMILES', 'Label']]
 
 #6. Import modules to split the dataset
 
@@ -349,7 +349,6 @@ def split_df_into_train_and_test_sets(df):
 
 # 8. Test and train datasets have been made
 
-HematoxLong2023=pd.read_csv("Long2023.csv")
 smiles_index = 0  # Because smiles is in the first column
 realistic = realistic_split(HematoxLong2023.copy(), smiles_index, 0.75, split_for_exact_frac=True, cluster_method="Auto")
 realistic_train, realistic_test = split_df_into_train_and_test_sets(realistic)