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Datasets:
jglaser
/
binding_affinity
like
20
Modalities:
Tabular
Text
Size:
1M - 10M
Tags:
molecules
chemistry
SMILES
Libraries:
Datasets
Croissant
Dataset card
Data Studio
Files
Files and versions
xet
Community
2
d7c19d0
binding_affinity
/
data
1 contributor
History:
15 commits
jglaser
add IC50 values back
d7c19d0
almost 5 years ago
dude
repartition DUD-E data
almost 5 years ago
all.parquet
59 MB
xet
update dataset to only inclulde Ki/Kd (but not IC50/EC50)
almost 5 years ago
all_ic50.parquet
211 MB
xet
add IC50 values back
almost 5 years ago
dcoid.parquet
598 kB
xet
add D-COID data set
almost 5 years ago
dcoid_predict.parquet
621 kB
xet
update predictions for D-COID and deepcoy/DEKOIS
almost 5 years ago
dcoid_rf2.parquet
148 kB
xet
add RF2 scoring for testing
almost 5 years ago
deepcoy_dekois_predict.parquet
3.66 MB
xet
update predictions for D-COID and deepcoy/DEKOIS
almost 5 years ago
deepcoy_dude_predict.parquet
38.8 MB
xet
update deepcoy DUDE predictions
almost 5 years ago
dude_predict.parquet
39.2 MB
xet
update predictions
almost 5 years ago
