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Datasets:
jglaser
/
binding_affinity
like
14
Modalities:
Tabular
Text
Size:
1M - 10M
Tags:
molecules
chemistry
SMILES
Libraries:
Datasets
Croissant
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Files
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Community
2
030a380
binding_affinity
1 contributor
History:
15 commits
jglaser
use pyarrow
030a380
over 3 years ago
data
add parquet file
over 3 years ago
.gitattributes
Safe
53 Bytes
add parquet file
over 3 years ago
README.md
Safe
1.94 kB
tweak script
over 3 years ago
binding_affinity.py
7.69 kB
use pyarrow
over 3 years ago
bindingdb.ipynb
Safe
25.9 kB
Add README.md, notebooks and preprocessing scripts
over 3 years ago
biolip.ipynb
Safe
17 kB
Add README.md, notebooks and preprocessing scripts
over 3 years ago
biolip.py
Safe
1.49 kB
Add README.md, notebooks and preprocessing scripts
over 3 years ago
combine_dbs.ipynb
Safe
60.4 kB
Add README.md, notebooks and preprocessing scripts
over 3 years ago
moad.ipynb
Safe
17.1 kB
Add README.md, notebooks and preprocessing scripts
over 3 years ago
moad.py
Safe
930 Bytes
Add README.md, notebooks and preprocessing scripts
over 3 years ago
pdbbind.ipynb
Safe
7.39 kB
Add README.md, notebooks and preprocessing scripts
over 3 years ago
pdbbind.py
Safe
1.18 kB
Add README.md, notebooks and preprocessing scripts
over 3 years ago
requirements.txt
Safe
56 Bytes
tweak script
over 3 years ago
