Comprehensive machine learning prediction of GC/MS pesticide recovery based on the molecular fingerprinting for food QA/QC
Postery | 2019 | Agilent TechnologiesInstrumentace
GC/MSD
ZaměřeníPotraviny a zemědělství
VýrobceAgilent Technologies
Klíčová slovalearning, machine, 𝑖𝑗, descriptor, smiles, recovery, pek, atoms, generalization, pesticide, prediction, index, pesticides, methods, 𝑦ത, correlation, σ𝑁, 𝑃𝐸𝑗, petitjean, polarizabilities, xlogp, caret, spline, topological, strings, number, category, ensemble, implicit, rate, hydrogens, sum, neural, ordinary, molecular, fingerprinting, coefficient, crops, between, performance, bound, sbc, xgblinear, σ𝑀, 𝑃𝐸𝑘, 𝑦𝑜𝑏𝑠, building, subtractive, rcdk, regression
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