File size: 633 Bytes
4fa42ce
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
{
  "shards": [
    "shard_000",
    "shard_001",
    "shard_002",
    "shard_003",
    "shard_004",
    "shard_005",
    "shard_006",
    "shard_007",
    "shard_008",
    "shard_009",
    "shard_010",
    "shard_011",
    "shard_012",
    "shard_013",
    "shard_014",
    "shard_015"
  ],
  "total": 7116053,
  "max_len": 120,
  "vocab_size": 79,
  "properties": [
    "MolWt",
    "MolLogP",
    "TPSA",
    "QED",
    "NumHDonors",
    "NumHAcceptors",
    "NumRotatableBonds",
    "NumAromaticRings",
    "NumRings",
    "FractionCSP3",
    "HeavyAtomCount"
  ],
  "constraints": "default"
}