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Datasets:
mireklzicar
/
synthonbench

Tasks:
Tabular Regression
Modalities:
Tabular
Text
Formats:
parquet
Size:
100M - 1B
Tags:
chemistry
cheminformatics
drug-discovery
virtual-screening
combinatorial-chemical-space
synthon
Libraries:
Datasets
Dask
Polars
License:
Dataset card Data Studio Files Files and versions
xet
Community
1
synthonbench / scores
10 GB
  • 1 contributor
History: 5 commits
mireklzicar's picture
mireklzicar
Add score-table sidecars (.sidx/.topk) for 1M, 10M, 100M + refresh card
19f7bb6 verified about 2 months ago
  • glide_1M.parquet.sidx
    Add score-table sidecars (.sidx/.topk) for 1M, 10M, 100M + refresh card about 2 months ago
  • glide_1M.parquet.topk
    Add score-table sidecars (.sidx/.topk) for 1M, 10M, 100M + refresh card about 2 months ago
  • surrogate_100M.parquet.sidx
    Add score-table sidecars (.sidx/.topk) for 1M, 10M, 100M + refresh card about 2 months ago
  • surrogate_100M.parquet.topk
    Add score-table sidecars (.sidx/.topk) for 1M, 10M, 100M + refresh card about 2 months ago
  • surrogate_10M.parquet.sidx
    Add score-table sidecars (.sidx/.topk) for 1M, 10M, 100M + refresh card about 2 months ago
  • surrogate_10M.parquet.topk
    Add score-table sidecars (.sidx/.topk) for 1M, 10M, 100M + refresh card about 2 months ago
  • surrogate_1M.parquet.sidx
    Add score-table sidecars (.sidx/.topk) for 1M, 10M, 100M + refresh card about 2 months ago
  • surrogate_1M.parquet.topk
    Add score-table sidecars (.sidx/.topk) for 1M, 10M, 100M + refresh card about 2 months ago
  • glide_1M.parquet
    95.9 MB
    xet
    Add synthon spaces, real-Glide + surrogate(1M) scores, seeds, dataset card 2 months ago
  • surrogate_100M.parquet
    4.83 GB
    xet
    Add 100M LightGBM surrogate score table 2 months ago
  • surrogate_10M.parquet
    479 MB
    xet
    Add 10M LightGBM surrogate score table 2 months ago
  • surrogate_1M.parquet
    46.9 MB
    xet
    Add 1M LightGBM surrogate score table 2 months ago