Support loading a weighted sum of multiple MS2 scores

aalto-ics-kepaco / msms_rt_ssvm

Implementation of the LC-MS²Struct model published in the manuscript "Joint structural annotation of small molecules using liquid chromatography retention order and tandem mass spectrometry data" by Bach et al.

MIT License

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Support loading a weighted sum of multiple MS2 scores #23

Closed bachi55 closed 3 years ago

bachi55 commented 3 years ago

multiple MS2 scoring methods can be specfied when loading the MS2 scores for the candidates
scores are combined using a weighted sum
weights can be specied by the user --> default is score average