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Datasets:
divelab
/
PubChemQCR
like
1
Follow
DIVE Lab, Texas A&M University
14
ArXiv:
arxiv:
2506.23008
License:
cc-by-4.0
Dataset card
Files
Files and versions
xet
Community
1
main
PubChemQCR
430 GB
2 contributors
History:
71 commits
congfu
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Code
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images
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.gitattributes
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Data01.lmdb
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Data02.lmdb
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Data05.lmdb
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Data06.lmdb
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Data07.lmdb
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Data10.lmdb
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Data11.lmdb
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Data12.lmdb
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README.md
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test.lmdb
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