build_pseudo_spectra_with_xic

rustdf::cluster::pseudo

Function build_pseudo_spectra_with_xic 

Source 
pub fn build_pseudo_spectra_with_xic(
    ds: &TimsDatasetDIA,
    ms1: &[ClusterResult1D],
    ms2: &[ClusterResult1D],
    features: &[SimpleFeature],
    cand_opts: &CandidateOpts,
    xic_opts: &XicScoreOpts,
    pseudo_opts: &PseudoSpecOpts,
) -> (Vec<PseudoSpectrum>, Vec<(usize, usize, f32)>)
Expand description

High-level entrypoint:

  1. enumerate geometric/tile-based candidates
  2. refine by XIC score (best precursor per fragment + cutoff)
  3. build pseudo-spectra from the surviving pairs