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. Author manuscript; available in PMC: 2022 Jun 8.
Published in final edited form as: Anal Chem. 2021 May 27;93(22):7860–7869. doi: 10.1021/acs.analchem.1c00359

Table 1.

Average accuracy, precision, and recall afforded by the ML classifiers in separate experiments.

KNN NB GB
Acc Prc Rec Acc Prc Rec Acc Prc Rec
a) S. typh. 1.00 1.00 1.00 0.99 0.96 1.00 0.99 0.96 1.00
K. aero. 1.00 1.00 1.00 1.00 1.00 1.00
OR:H48:K 1.00 1.00 1.00 0.95 1.00 0.96
b) OR:H48:K 1.00 1.00 1.00 0.98 1.00 0.96 1.00 1.00 1.00
O157:H7 1.00 1.00 0.96 1.00 1.00 1.00
c) BY4741 0.88 1.00 0.88 0.85 0.75 0.75 0.96 0.89 1.00
set1Δ 1.00 1.00 1.00 1.00 1.00 1.00
trf4Δ 0.73 1.00 0.80 1.00 1.00 0.88
rit1Δ 1.00 0.71 1.00 0.71 1.00 1.00
d) HeLa 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00
HEK 293T 1.00 1.00 1.00 1.00 1.00 1.00
U-251 MG 1.00 1.00 1.00 1.00 1.00 1.00
e) astrocytes 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00
microglia 1.00 1.00 1.00 1.00 1.00 1.00
neurons 1.00 1.00 1.00 1.00 1.00 1.00

Differentiation of a) members of the Enterobacteriaceae family (i.e., S. typhimurium, K. aerogenes, and E. coli OR:H48:K, each with testing N = 8); b) E. coli serotypes (i.e., OR:H48:K and O157:H7, N = 8 ea.); c) wildtype and deletion mutants of S. cerevisiae (i.e., BY4741, trf4Δ, and rit1Δ N = 8 ea., set1Δ N=3); d) immortalized human cell lines from different organs (i.e., HEK 293T and HeLa N = 8 ea., and U-251 MG N = 10); and e) primary human cell lines from the central nervous system (i.e., astrocytes N = 3, microglia N = 15, and neurons (N = 5). N indicates the number of rPTM profiles utilized exclusively during the testing phase (i.e., 30% of the entire set available for each class, see Experimental).