Protein Fragmentation
Overview
JPLPeptideFragmenter is making the fragmentation of a given JPLPeptide precursor, and a set of given JPLFragmentationType(s).
Examples
JPLPeptide precursorSeq = new JPLPeptideBuilder("DELHIVEAEAMNYEGSPIK").build(); JPLPeptideFragmenter fragmenter = new JPLPeptideFragmenter.Builder(EnumSet.of( JPLFragmentationType.BY, JPLFragmentationType.PRECURSOR, JPLFragmentationType.IMMONIUM)).build(); fragmenter.setFragmentablePrecursor(precursorSeq, 1); fragmenter.generateFragments(); JPLTheoMSnPeakList bypiPl = fragmenter.getPeakList();