更新 data_processed.ipynb

data_processed.ipynb

@@ -66,7 +66,7 @@
    "outputs": [],
    "source": [
     "#train_data:40008 #test_data:5007 #val_data:5001\n",
-    "X = pd.read_csv('cano_data_processed.csv').values\n",
+    "X = pd.read_csv('USPTO-50k.csv').values\n",
     "cano_SMIELS = np.array(X[:,5])\n",
     "labels = np.array(X[:,8])\n",
     "molecule_SMIELS = np.array(X[:,3])"