Datasets:

mireklzicar
/

synthonbench

Tasks:

Tabular Regression

Modalities:

Formats:

Size:

Tags:

cheminformatics

virtual-screening

combinatorial-chemical-space

Libraries:

License:

Dataset card Data Studio Files Files and versions

synthonbench / spaces

1 contributor

History: 1 commit

mireklzicar's picture

Add synthon spaces, real-Glide + surrogate(1M) scores, seeds, dataset card

b3ed55c verified 10 days ago

reactions.tsv

4 kB
Add synthon spaces, real-Glide + surrogate(1M) scores, seeds, dataset card 10 days ago
synthon_space_100M.properties.csv

1.16 MB
Add synthon spaces, real-Glide + surrogate(1M) scores, seeds, dataset card 10 days ago
synthon_space_100M.synthons.tsv

1.56 MB
Add synthon spaces, real-Glide + surrogate(1M) scores, seeds, dataset card 10 days ago
synthon_space_10M.properties.csv

505 kB
Add synthon spaces, real-Glide + surrogate(1M) scores, seeds, dataset card 10 days ago
synthon_space_10M.synthons.tsv

688 kB
Add synthon spaces, real-Glide + surrogate(1M) scores, seeds, dataset card 10 days ago
synthon_space_1M.properties.csv

228 kB
Add synthon spaces, real-Glide + surrogate(1M) scores, seeds, dataset card 10 days ago
synthon_space_1M.synthons.tsv

314 kB
Add synthon spaces, real-Glide + surrogate(1M) scores, seeds, dataset card 10 days ago