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| Class [owl:Class] |
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| A Spectrum needs to specify a few identifying information (precursorIntensity, precursorMZ, scanId, and spectrumId) so that it can be retrieved from a link and in order to be useful in de novo sequencing. A Spectrum can either provide the SpectrumData as a CSV or a Link to another object e.g., an mzML file. CSV enables the DNMSO file to be self-contained. Linking to mzML files is encouraged. |
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| Spectrum; a mass spectrum for de novo sequencing. |
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| Thing |
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| scanId; the scan number of the spectrum. exactly 1 |
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| precursorMZ; the m/z of the precursor peak. exactly 1 |
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| Class [owl:Class] |
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| precursorIntensity; ihe intensity of the precursor peak. exactly 1 |
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| csvPeakList; spectrum in CSV format. max 1 |
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| spectrumId; the spectrum ID (unique identifier per DNMSO instance). exactly 1 |
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