ms2ScoreSpectralEntropy: Title Give MSMS Score using spectral entropy.

View source: R/ms2ScoreSpectralEntropy.R

ms2ScoreSpectralEntropyR Documentation

Title Give MSMS Score using spectral entropy.

Description

Title Give MSMS Score using spectral entropy.

Usage

ms2ScoreSpectralEntropy(
  spec_query,
  spec_reference,
  ms2_da,
  need_clean_spectra = TRUE,
  noise_removal = 0.01
)

Arguments

spec_query,

measured ms2

spec_reference,

ms2 in database

ms2_da,

the tolerence between ms2Act and ms2DB

Value

scoreOfMS2

References

Li, Y., Kind, T., Folz, J. et al. Spectral entropy outperforms MS/MS dot product similarity for small-molecule compound identification. Nat Methods 18, 1524–1531 (2021). https://doi.org/10.1038/s41592-021-01331-z


zhengfj1994/MetEx documentation built on Nov. 19, 2023, 1:34 p.m.