Rdisop: Decomposition of Isotopic Patterns

Identification of metabolites using high precision mass spectrometry. MS Peaks are used to derive a ranked list of sum formulae, alternatively for a given sum formula the theoretical isotope distribution can be calculated to search in MS peak lists.

Package details

AuthorAnton Pervukhin <[email protected]>, Steffen Neumann <[email protected]>
Bioconductor views MassSpectrometry Metabolomics
MaintainerSteffen Neumann <[email protected]>
URL https://github.com/sneumann/Rdisop
Package repositoryView on Bioconductor
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Rdisop documentation built on Nov. 1, 2018, 4:33 a.m.