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Datasets:
jglaser
/
binding_affinity
like
14
Modalities:
Tabular
Text
Size:
1M - 10M
Tags:
molecules
chemistry
SMILES
Libraries:
Datasets
Croissant
Dataset card
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Files
Files and versions
Community
2
9737168
binding_affinity
/
data
Commit History
make smiles canonical
9737168
jglaser
commited on
Jul 5, 2021
update deepcoy DUDE predictions
91dc8a9
jglaser
commited on
Jul 4, 2021
update predictions for D-COID and deepcoy/DEKOIS
c066e7c
jglaser
commited on
Jul 2, 2021
add deepcoy DEKOIS and DUDE predictions
fe94b5c
jglaser
commited on
Jun 29, 2021
add RF2 scoring for testing
0a05de5
jglaser
commited on
Jun 28, 2021
add D-COID data set
d802ce7
jglaser
commited on
Jun 25, 2021
update predictions
acf20bc
jglaser
commited on
Jun 25, 2021
add DUDE predictions
87404f2
jglaser
commited on
Jun 24, 2021
repartition DUD-E data
8a87fcb
jglaser
commited on
Jun 24, 2021
add DUDE test data set
c3db9b7
jglaser
commited on
Jun 24, 2021
normalize affinities
85bd2ca
jglaser
commited on
May 27, 2021
remove outliers
5225bab
jglaser
commited on
May 27, 2021
add parquet file
89a844e
jglaser
commited on
May 25, 2021
jglaser
commited on
