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Update MFAssignR/R/MFAssign.R
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hechth authored Dec 13, 2023
1 parent dfd0bba commit 5a9b449
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2 changes: 0 additions & 2 deletions MFAssignR/R/MFAssign.R
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Expand Up @@ -192,8 +192,6 @@ MFAssign <- function(peaks, isopeaks = "none", ionMode, lowMW=100,highMW=1000, P
"I","M", "NH4", "POE", "NOE", "Z"))

numComps <- length(components)
# proton = 1.00727645216 # mass of proton
# electron = 0.000548597 # mass of electron
fitMode <- "ppm"
maxErr <- ppm_err
numDigits <- 6
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