-
-
-
-
-
-
Active filters:
SMILES
Viewer
•
Updated
•
3.67M
•
3.06k
•
16
jglaser/pdb_protein_ligand_complexes
Updated
•
102
•
6
jglaser/protein_ligand_contacts
Viewer
•
Updated
•
20.8k
•
128
•
6
jglaser/pdbbind_complexes
Viewer
•
Updated
•
16.1k
•
169
sagawa/pubchem-10m-canonicalized
Viewer
•
Updated
•
10M
•
191
•
1
sagawa/ZINC-canonicalized
Viewer
•
Updated
•
23M
•
147
djh992/pdbbind_complex_GB2022
Viewer
•
Updated
•
14.9k
•
148
•
1
BASF-AI/PubChemSMILESCanonDescPC
Viewer
•
Updated
•
2.05k
•
35
BASF-AI/PubChemSMILESCanonTitlePC
Viewer
•
Updated
•
2.05k
•
32
BASF-AI/PubChemSMILESIsoTitlePC
Viewer
•
Updated
•
2.05k
•
34
BASF-AI/CoconutSMILES2FormulaPC
Viewer
•
Updated
•
4k
•
35
BASF-AI/CoconutSmiles2NameBitextMining
Viewer
•
Updated
•
622k
•
33
BASF-AI/CoconutSMILES2FormulaBM
Viewer
•
Updated
•
4k
•
44
BASF-AI/CoconutSmiles2NameBitextMining2
Viewer
•
Updated
•
5k
•
39
molssiai-hub/pubchem-07-23-2024
Updated
•
35
•
1
BASF-AI/PubChemSMILESIsoTitleBM
Viewer
•
Updated
•
7.07k
•
44
BASF-AI/PubChemSMILESIsoDescBM
Viewer
•
Updated
•
7.07k
•
42
BASF-AI/PubChemSMILESCanonTitleBM
Viewer
•
Updated
•
15.5k
•
35
BASF-AI/PubChemSMILESCanonDescBM
Viewer
•
Updated
•
15.5k
•
37
scbirlab/lyu-wang-balius-singh-2019-ampc
Viewer
•
Updated
•
96.2M
•
124
scbirlab/lyu-wang-balius-singh-2019-d4
Viewer
•
Updated
•
116M
•
161
molssiai-hub/pubchem-10-15-2024
Updated
•
101
molssiai-hub/pubchem-10-15-2024-selfies
Updated
•
36
scbirlab/cyc-pep-6-12mer-70M-2024
Viewer
•
Updated
•
125M
•
226
scbirlab/steshin-2023-lohi
Viewer
•
Updated
•
119k
•
112
scbirlab/fang-2023-biogen-adme
Viewer
•
Updated
•
7.04k
•
91
scbirlab/cyc-pep-6-12mer-650M-2024
Viewer
•
Updated
•
1.2B
•
139
•
1
scbirlab/hudson-2023-dosedo
Viewer
•
Updated
•
7.45M
•
166
Viewer
•
Updated
•
21.5M
•
1.17k
•
1
molssiai-hub/pubchem-02-21-2025