Upload dataset

CHEMBL3979_EC50/test-00000-of-00001.parquet

@@ -0,0 +1,3 @@
+version https://git-lfs.github.com/spec/v1
+oid sha256:0133d3d12260bdaf7f4d84e53e8f8e26782762804c25d0834a90412f017ccaed
+size 14562

CHEMBL3979_EC50/train-00000-of-00001.parquet

@@ -0,0 +1,3 @@
+version https://git-lfs.github.com/spec/v1
+oid sha256:c60da69ec154a30e100c48addf40070542a7b2e38b599bddc431d1b6a360432f
+size 37160

README.md

@@ -406,6 +406,35 @@ dataset_info:
     num_examples: 574
   download_size: 120619
   dataset_size: 335770
+- config_name: CHEMBL3979_EC50
+  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: 119978
+    num_examples: 899
+  - name: test
+    num_bytes: 30376
+    num_examples: 226
+  download_size: 51722
+  dataset_size: 150354
 - config_name: CHEMBL4203_Ki
   features:
   - name: smiles
@@ -549,6 +578,12 @@ configs:
     path: CHEMBL264_Ki/train-*
   - split: test
     path: CHEMBL264_Ki/test-*
+- config_name: CHEMBL3979_EC50
+  data_files:
+  - split: train
+    path: CHEMBL3979_EC50/train-*
+  - split: test
+    path: CHEMBL3979_EC50/test-*
 - config_name: CHEMBL4203_Ki
   data_files:
   - split: train