Hugging Face
Models
Datasets
Spaces
Posts
Docs
Enterprise
Pricing
Log In
Sign Up
Datasets:
jglaser
/
binding_affinity
like
14
Modalities:
Tabular
Text
Size:
1M - 10M
Tags:
molecules
chemistry
SMILES
Libraries:
Datasets
Croissant
Dataset card
Viewer
Files
Files and versions
Community
2
75e835a
binding_affinity
/
data
/
all.parquet
Commit History
update datasets
36e04be
jglaser
commited on
Feb 6, 2022
update to most recent DBs, add split without KRAS
558c2c3
jglaser
commited on
Nov 19, 2021
update dataset to only inclulde Ki/Kd (but not IC50/EC50)
fad2eb6
jglaser
commited on
Jul 7, 2021
make smiles canonical
9737168
jglaser
commited on
Jul 5, 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
