Upload dataset

CHEMBL204_Ki/test-00000-of-00001.parquet

@@ -0,0 +1,3 @@
+version https://git-lfs.github.com/spec/v1
+oid sha256:fa68bbf50463caa4ed866e1cf8a9fbf113e5d86c40c4f5804077fee9f3805f76
+size 30403

CHEMBL204_Ki/train-00000-of-00001.parquet

@@ -0,0 +1,3 @@
+version https://git-lfs.github.com/spec/v1
+oid sha256:4d6cbe31ee644bd6cf2e170d13e762171d5b0401f332c4f1b71799552ec8ddab
+size 96354

README.md

@@ -58,6 +58,35 @@ dataset_info:
     num_examples: 134
   download_size: 37476
   dataset_size: 96433
+- config_name: CHEMBL204_Ki
+  features:
+  - name: smiles
+    dtype: string
+  - name: exp_mean [nM]
+    dtype: float64
+  - name: y
+    dtype: float64
+  - name: cliff_mol
+    dtype: int64
+  - name: activity_value
+    dtype: float64
+  - name: protein_sequence
+    dtype: 'null'
+  - name: chembl_id
+    dtype: string
+  - name: task
+    dtype: string
+  - name: __index_level_0__
+    dtype: int64
+  splits:
+  - name: train
+    num_bytes: 304179
+    num_examples: 2201
+  - name: test
+    num_bytes: 76381
+    num_examples: 553
+  download_size: 126757
+  dataset_size: 380560
 - config_name: CHEMBL2147_Ki
   features:
   - name: smiles
@@ -245,6 +274,12 @@ configs:
     path: CHEMBL1871_Ki/train-*
   - split: test
     path: CHEMBL1871_Ki/test-*
+- config_name: CHEMBL204_Ki
+  data_files:
+  - split: train
+    path: CHEMBL204_Ki/train-*
+  - split: test
+    path: CHEMBL204_Ki/test-*
 - config_name: CHEMBL2147_Ki
   data_files:
   - split: train