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Datasets:
ilkhamfy
/
IRexp
Like
0
Modalities:
Text
Formats:
json
Languages:
English
Size:
100K - 1M
Tags:
chemistry
spectroscopy
infrared
nmr
cheminformatics
open-data
Libraries:
Datasets
pandas
Polars
+ 1
License:
cc-by-4.0
cc-by-sa-4.0
cc-by-nc-4.0
Dataset card
Data Studio
Files
Files and versions
xet
Community
1
main
IRexp
/
data
22.8 MB
Ctrl+K
Ctrl+K
1 contributor
History:
3 commits
ilkhamfy
presubmit: align has_structure to SMILES (6); publish CC-BY-ND other (5); card cc-by-nc-4.0
4312254
verified
5 days ago
SHA256SUMS.txt
Safe
758 Bytes
presubmit: align has_structure to SMILES (6); publish CC-BY-ND other (5); card cc-by-nc-4.0
5 days ago
f1_commercial_build_stats.json
Safe
1.58 kB
presubmit: align has_structure to SMILES (6); publish CC-BY-ND other (5); card cc-by-nc-4.0
5 days ago
irexp_commercial.jsonl.gz
Safe
10.9 MB
xet
presubmit: align has_structure to SMILES (6); publish CC-BY-ND other (5); card cc-by-nc-4.0
5 days ago
irexp_non_commercial.jsonl.gz
Safe
2.42 MB
xet
release: reapply band-count filter and dedup integer bands
5 days ago
irexp_other.jsonl.gz
Safe
700 Bytes
xet
presubmit: align has_structure to SMILES (6); publish CC-BY-ND other (5); card cc-by-nc-4.0
5 days ago
irexp_resolved_commercial.jsonl.gz
Safe
4.65 MB
xet
presubmit: align has_structure to SMILES (6); publish CC-BY-ND other (5); card cc-by-nc-4.0
5 days ago
irexp_sharealike.jsonl.gz
Safe
258 kB
xet
release: reapply band-count filter and dedup integer bands
5 days ago
patch_meta.json
Safe
4.77 kB
release: reapply band-count filter and dedup integer bands
5 days ago
patch_meta_presubmit.json
Safe
902 Bytes
presubmit: align has_structure to SMILES (6); publish CC-BY-ND other (5); card cc-by-nc-4.0
5 days ago
train_no_bench_commercial.jsonl.gz
Safe
4.63 MB
xet
presubmit: align has_structure to SMILES (6); publish CC-BY-ND other (5); card cc-by-nc-4.0
5 days ago