changed predict function name

predict.py

@@ -6,7 +6,7 @@ from src.model import GIN
 from src.preprocess import create_clean_mol_objects
 from src.seed import set_seed
 
-def predict_from_smiles(smiles_list):
+def predict(smiles_list):
     """
     Predict toxicity targets for a list of SMILES strings.