Hugging Face's logo

Datasets:
chandar-lab
/
ZINC_22

Modalities:
Text
Formats:
parquet
Size:
1B - 10B
ArXiv:
Libraries:
Datasets
Dask
Dataset card Data Studio Files Community
1
msb-roshan commited on
Commit
53c76a6
·
verified ·
1 Parent(s): c106cfe

Upload dataset (part 00024-of-00025)

Browse files
Files changed (19) hide show
  1. README.md +15 -11
  2. data/test-00000-of-00003.parquet +3 -0
  3. data/test-00001-of-00003.parquet +3 -0
  4. data/test-00002-of-00003.parquet +3 -0
  5. data/train-01200-of-01212.parquet +3 -0
  6. data/train-01201-of-01212.parquet +3 -0
  7. data/train-01202-of-01212.parquet +3 -0
  8. data/train-01203-of-01212.parquet +3 -0
  9. data/train-01204-of-01212.parquet +3 -0
  10. data/train-01205-of-01212.parquet +3 -0
  11. data/train-01206-of-01212.parquet +3 -0
  12. data/train-01207-of-01212.parquet +3 -0
  13. data/train-01208-of-01212.parquet +3 -0
  14. data/train-01209-of-01212.parquet +3 -0
  15. data/train-01210-of-01212.parquet +3 -0
  16. data/train-01211-of-01212.parquet +3 -0
  17. data/valid-00000-of-00003.parquet +3 -0
  18. data/valid-00001-of-00003.parquet +3 -0
  19. data/valid-00002-of-00003.parquet +3 -0
README.md CHANGED
@@ -2,21 +2,25 @@
2
  dataset_info:
3
  features:
4
  - name: SMILES
5
- dtype: large_string
6
- - name: ID
7
- dtype: large_string
 
 
 
 
8
  splits:
9
  - name: train
10
- num_bytes: 130226291035.04411
11
- num_examples: 1493998932
12
  - name: valid
13
- num_bytes: 261484687
14
- num_examples: 2999998
15
  - name: test
16
- num_bytes: 262646353
17
- num_examples: 2999998
18
- download_size: 62576968968
19
- dataset_size: 130750422075.04411
20
  configs:
21
  - config_name: default
22
  data_files:
 
2
  dataset_info:
3
  features:
4
  - name: SMILES
5
+ dtype: string
6
+ - name: Deep SMILES
7
+ dtype: string
8
+ - name: SELFIES
9
+ dtype: string
10
+ - name: SAFE
11
+ dtype: string
12
  splits:
13
  - name: train
14
+ num_bytes: 605949364569
15
+ num_examples: 1485280171
16
  - name: valid
17
+ num_bytes: 1248532124
18
+ num_examples: 2999216
19
  - name: test
20
+ num_bytes: 1264493396
21
+ num_examples: 2999132
22
+ download_size: 241151459346
23
+ dataset_size: 608462390089
24
  configs:
25
  - config_name: default
26
  data_files:
data/test-00000-of-00003.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:bb80a55a23551d305341197e5fbb4267fad1469b2f7930c92d5e2f18d3891f7d
3
+ size 131914470
data/test-00001-of-00003.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:a8fd5cd567967d68151dc6ef3b01d24aab4a6af1b62f9d61e9ad22a87c911a01
3
+ size 132892545
data/test-00002-of-00003.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:d70fa64134a7eb2f14a24ca371e177578a65ff1464d54862335eb13a61bec2bd
3
+ size 132252022
data/train-01200-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:3b3bb55335ea8bca7bd9cab8cf0f92504479f04af353be42cc703d249d99349b
3
+ size 198255652
data/train-01201-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:935da322b5f50b1270c5448287a5d00c9bd926bbf18ddd8f63383096119c18d3
3
+ size 198265839
data/train-01202-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:d632c13ae1e2f5fad2743da375161e5728c2f28d99657ad5cedd4a9701fbc9e3
3
+ size 198191168
data/train-01203-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:6f3916a727a5ee236e5637ea735f78dd10ec5012d20d2e90351793d600887f01
3
+ size 198265783
data/train-01204-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:4667045147a250db15b735f69574ee2ba25a458264e9402ef74af1153f088451
3
+ size 198210829
data/train-01205-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:ee4ae7a5306ac480fc98c385f2d1b305bdeaf5d98f277a6a5746d409983aab2e
3
+ size 198240470
data/train-01206-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:e18cf5354a891460b105ed962371148c00d92e070ccea1a269ca84a656804360
3
+ size 198219261
data/train-01207-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:b0cf6c23121cd9566423c978e5d26f042f3210d7082bd6a62e2eba28dcd610dd
3
+ size 198209146
data/train-01208-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:3916f6e06d6a1c8e97542e4425b46cde4ce67c454cc4c9964d616454b69454d3
3
+ size 198219400
data/train-01209-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:be613caa4b267b5cc9a71b3da501d4e177449356a9a25ac35bc285bdf251aa5b
3
+ size 198225569
data/train-01210-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:01c0e2b475441336e5a11d1bd28df43df9fdae056606a14772e6f5c602201801
3
+ size 198219742
data/train-01211-of-01212.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:1cc030b83188804d6e1cd825aad00fb94bce2e1a8453f9e7bfceebfda0949a57
3
+ size 198245410
data/valid-00000-of-00003.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:d9ca74a3aa8ab5316773f9126be2620e67d24cdd33f626edad0081b1073cf4cd
3
+ size 166148402
data/valid-00001-of-00003.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:28d6e83f67ceb11c254c168989b50fbacdf250a9789243f31b8be4a5a3ad249e
3
+ size 166163896
data/valid-00002-of-00003.parquet ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:a3fa87f3b330d851b3d5057f35da96d76751f6be4ea8174fa8a9c37248a60609
3
+ size 166146285