Network analysis from a list of molecules
An R package for spectral binning of FIE-HRMS metabolomic fingerprinting data
AdducTrackR is an R package designed to compute all possible peptide oligomers from the exact masses of proteinogenic amino acids, for any specified degree of oligomerization. It supports in silico modeling of peptide-polyphenol interactions to assist in the annotation of high-resolution mass spectrometry data.
A mirror of the SCHON repository in a non-final stage of development
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