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Datasets:
EscheWang
/
3dcs-embeddings
Like
0
Modalities:
3D
Size:
10M<n<100M
ArXiv:
arxiv:
2106.08903
arxiv:
2502.16284
arxiv:
2206.07697
Tags:
chemistry
molecules
3d
conformers
embeddings
benchmark
License:
cc-by-sa-4.0
Dataset card
Files
Files and versions
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3dcs-embeddings
/
traj
/
gemnet
512 MB
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1 contributor
History:
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EscheWang
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rmd17_aspirin.npz
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rmd17_azobenzene.npz
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rmd17_malonaldehyde.npz
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