Package for calculating aggregated isotopic distribution and exact center-masses for chemical substances (in this version composed of C, H, N, O and S). This is an implementation of the BRAIN algorithm described in the paper by J. Claesen, P. Dittwald, T. Burzykowski and D. Valkenborg.
|Author||Piotr Dittwald, with contributions of Dirk Valkenborg and Jurgen Claesen|
|Bioconductor views||MassSpectrometry Proteomics|
|Maintainer||Piotr Dittwald <[email protected]>|
|Package repository||View on GitHub|
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