compile_CSI-MolFps.knwf
Dataset description:
Nontarget high-resolution mass spectrometry screening (NTS HRMS/MS) can detect thousands of organic substances in environmental samples. However, new strategies are needed to focus time-...
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Additional Information
Last updated | June 7, 2023 |
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Created | June 7, 2023 |
Format | unknown |
Size | 215.3 MB |
Resource Type | Workflow |
Cite as | A KNIME workflow for compilation of molecular fingerprints generated by SIRIUS and used by MLinvitroTox. |
Hash | c6a40d6cb757adead25cbb9d3c84e46c82c0053955f95b930bc3c382d959aaf2 |
Hashtype | sha256 |