2 datasets found

Keywords: Cheminformatics

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  • SAVI-Space

    This dataset was published as part of SAVI Space—combinatorial encoding of the billion-size synthetically accessible virtual inventory (Korn, M., Judson, P., Klein, R. et...

  • Chemotion Repository - Data collection: FT-IR spectroscopy data (Chemotion IR)

    This dataset comprises experimental data obtained from the characterization of chemical compounds synthesized across various chemical laboratories. The data was published in the...
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