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Automatic Assignment of Molecular Ion Species to Elemental Formulas in Gas Chromatography/Methane Chemical Ionization Accurate Mass Spectrometry.
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- Metabolites (2218-1989), 2023, v. 13, n. 8, p. 962, doi. 10.3390/metabo13080962
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Predicting in silico electron ionization mass spectra using quantum chemistry.
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- Journal of Cheminformatics, 2020, v. 12, n. 1, p. 1, doi. 10.1186/s13321-020-00470-3
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- Article