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Datasets:
EscheWang
/
3dcs
Like
0
Modalities:
Tabular
Text
Time-series
+ 1
Formats:
parquet
optimized-parquet
Size:
1M - 10M
Tags:
chemistry
molecules
3d
conformers
chirality
benchmark
+ 1
Libraries:
Datasets
Dask
Polars
+ 1
License:
cc-by-sa-4.0
Dataset card
Data Studio
Files
Files and versions
xet
Community
main
3dcs
7.98 GB
Ctrl+K
Ctrl+K
1 contributor
History:
8 commits
EscheWang
Describe the chirality conformer generation in the dataset card
f224dc0
verified
24 days ago
data
Replace float32-quantized energies with original float64 rMD17 energies
25 days ago
.gitattributes
Safe
2.5 kB
initial commit
26 days ago
README.md
Safe
12.5 kB
Describe the chirality conformer generation in the dataset card
24 days ago
