Selected article for: "ionization adduct type and molecular formula"
Author: Marcus Ludwig; Louis-Félix Nothias; Kai Dührkop; Irina Koester; Markus Fleischauer; Martin A. Hoffmann; Daniel Petras; Fernando Vargas; Mustafa Morsy; Lihini Aluwihare; Pieter C. Dorrestein; Sebastian Böcker
Title: ZODIAC: database-independent molecular formula annotation using Gibbs sampling reveals unknown small molecules
  • Document date: 2019_11_16
    • ID: 03uonbrv_47
    Snippet: If OpenMS provided an ionization adduct type (such as protonation, sodium adduct, potassium adduct) for a compound, only this ionization was used. We export the 50 best-scoring molecular formula candidates from SIRIUS......
    Document: If OpenMS provided an ionization adduct type (such as protonation, sodium adduct, potassium adduct) for a compound, only this ionization was used. We export the 50 best-scoring molecular formula candidates from SIRIUS.

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