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  1. airPLS airPLS Public

    baseline correction using adaptive iteratively reweighted Penalized Least Squares

    Python 117 27

  2. libPeak libPeak Public

    Methods of peak detection for analytical instruments

    Python 49 14

  3. baselineWavelet baselineWavelet Public

    Intelligent background-correction algorithm for highly fluorescent sample in Raman spectroscopy

    R 26 18

  4. TEAM TEAM Public

    Transfer via Extreme learning machine Auto-encoder Method (TEAM)

    Python 19 9

  5. SigmaCCS SigmaCCS Public

    Highly accurate and large-scale collision cross section prediction with graph neural network for compound identification

    Jupyter Notebook 15 7

  6. pymass pymass Public

    Package for analyzing MS with Python

    C 11 5