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Generating theoretical fragment spectra is central to many identification tasks in computational mass spectrometry. TheoreticalSpectrumGenerator can be configured to generate tandem MS spectra from a given peptide charge combination. There are various parameters which influence the generated ions e.g. simulating different fragmentation techniques.

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ElshaymaaAhmed/Fragment-spectrum-generation

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Fragment-spectrum-generation

Generating theoretical fragment spectra is central to many identification tasks in computational mass spectrometry. TheoreticalSpectrumGenerator can be configured to generate tandem MS spectra from a given peptide charge combination. There are various parameters which influence the generated ions e.g. simulating different fragmentation techniques.

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Generating theoretical fragment spectra is central to many identification tasks in computational mass spectrometry. TheoreticalSpectrumGenerator can be configured to generate tandem MS spectra from a given peptide charge combination. There are various parameters which influence the generated ions e.g. simulating different fragmentation techniques.

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