Datasets:
anonymousttt2025
/
MolA

Dataset card Data Studio Files
xet
 Community
1
file_path
stringlengths
35
35
smiles
stringlengths
2
469
coords
stringlengths
17
1.29k
edges
stringlengths
16
2.57k
num_atoms
int64
2
99
coords_bbox
stringlengths
32
2.39k
has_sgroup
bool
2 classes
charges
stringlengths
6
319
isotopes
stringlengths
6
300
year
int64
2k
2.02k
file_id
stringlengths
35
35
batch_id
int64
0
10
explicit_smiles
stringlengths
3
480
explicit_smi_len
int64
3
480
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