遇见数据集

PubChem SMARTS target-index shards

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Zenodo2026-04-30 更新2026-05-26 收录
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Persisted smarts-rs target-index shards built from the PubChem CID-SMILES corpus. The archive contains 9 zstd-compressed epserde shard files covering 123857298 target records, one zstd-compressed target-SMILES sidecar per shard, one zstd-compressed external-ID sidecar per shard, and a JSON manifest. Decompress the .eps.zst, .target-smiles.eps.zst and .external-ids.eps.zst files before mmap-backed querying.

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Zenodo
创建时间:
2026-04-30
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