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new datasets #144

Merged
merged 1 commit into from
Jul 20, 2023
Merged

new datasets #144

merged 1 commit into from
Jul 20, 2023

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corinnabrungs
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Compounds were automatically annotated by MZmine and a compound table. Those annotated compounds were exported in the RepoRT format directly with MZmine. Multipe RTs for a compound are possible (if the same m/z occurred multiple times within one injection). This might be for multiple adducts and isomers

@f-kretschmer f-kretschmer merged commit b734170 into michaelwitting:master Jul 20, 2023
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@f-kretschmer f-kretschmer mentioned this pull request Jul 20, 2023
@f-kretschmer f-kretschmer mentioned this pull request Aug 9, 2023
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2 participants