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Competitive fragmentation modeling of ESI-MS/MS spectra for putative metabolite identification

Unknown author(s)

Metabolomics · 2014 · 410 citations · 32 references

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References

32

Maximum Likelihood from Incomplete Data Via the <i>EM</i> Algorithm

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Probability-based protein identification by searching sequence databases using mass spectrometry data

David N. Perkins, Darryl Pappin, David M. Creasy et al. · Electrophoresis · 1999 · 8.3K citations

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An approach to correlate tandem mass spectral data of peptides with amino acid sequences in a protein database

Jimmy K. Eng, Ashley L. McCormack, John R. Yates · Journal of the American Society for Mass Spectrometry · 1994 · 6.6K citations

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Proposed minimum reporting standards for chemical analysis

Lloyd W. Sumner, Alexander Amberg, Michael H. Beale et al. · Metabolomics · 2007 · 5K citations · Full text

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Iterative partial equalization of orbital electronegativity—a rapid access to atomic charges

Johann Gasteiger, Mario Marsili · Tetrahedron · 1980 · 4.1K citations

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