Add herg_blockers-multimodal config via script

README.md

@@ -638,6 +638,42 @@ dataset_info:
     num_examples: 1862
   download_size: 13942052
   dataset_size: 211018039.89000002
+- config_name: herg_blockers-multimodal
+  features:
+  - name: IMAGE
+    dtype: image
+  - name: template
+    dtype: string
+  - name: template_original
+    dtype: string
+  - name: SMILES
+    dtype: string
+  - name: SMILES_ORIGINAL
+    dtype: string
+  - name: SELFIES
+    dtype: string
+  - name: InChI
+    dtype: string
+  - name: IUPAC
+    dtype: string
+  - name: split
+    dtype: string
+  - name: compound_name
+    dtype: string
+  - name: herg_blocker
+    dtype: int64
+  splits:
+  - name: train
+    num_bytes: 133140919.0
+    num_examples: 7600
+  - name: test
+    num_bytes: 34749019.77
+    num_examples: 2071
+  - name: validation
+    num_bytes: 32830759.53
+    num_examples: 1919
+  download_size: 13267691
+  dataset_size: 200720698.3
 - config_name: herg_karim_et_al-multimodal
   features:
   - name: IMAGE
@@ -1147,6 +1183,14 @@ configs:
     path: half_life_obach-multimodal/test-*
   - split: validation
     path: half_life_obach-multimodal/validation-*
+- config_name: herg_blockers-multimodal
+  data_files:
+  - split: train
+    path: herg_blockers-multimodal/train-*
+  - split: test
+    path: herg_blockers-multimodal/test-*
+  - split: validation
+    path: herg_blockers-multimodal/validation-*
 - config_name: herg_karim_et_al-multimodal
   data_files:
   - split: train

herg_blockers-multimodal/test-00000-of-00001.parquet

@@ -0,0 +1,3 @@
+version https://git-lfs.github.com/spec/v1
+oid sha256:2c924bf8b60a285e2a8067a5759b55d844940af3c39a827c4f45786c0a29074c
+size 2302132

herg_blockers-multimodal/train-00000-of-00001.parquet

@@ -0,0 +1,3 @@
+version https://git-lfs.github.com/spec/v1
+oid sha256:d00587c73084640b719cc4d250c1918dc9b6ee62f1d25af17c1e53c30cd8831c
+size 8834033

herg_blockers-multimodal/validation-00000-of-00001.parquet

@@ -0,0 +1,3 @@
+version https://git-lfs.github.com/spec/v1
+oid sha256:12b858c42ada5da92896e7dcaceb8ccfa1504990ccbb8dee8d0cf9f0789a0d80
+size 2131526