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Identifying the unknowns by aligning fragmentation trees.
Rasche F, Scheubert K, Hufsky F, Zichner T, Kai M, Svatoš A, Böcker S. Rasche F, et al. Among authors: bocker s. Anal Chem. 2012 Apr 3;84(7):3417-26. doi: 10.1021/ac300304u. Epub 2012 Mar 20. Anal Chem. 2012. PMID: 22390817
Fast alignment of fragmentation trees.
Hufsky F, Dührkop K, Rasche F, Chimani M, Böcker S. Hufsky F, et al. Among authors: bocker s. Bioinformatics. 2012 Jun 15;28(12):i265-73. doi: 10.1093/bioinformatics/bts207. Bioinformatics. 2012. PMID: 22689771 Free PMC article.
Molecular Formula Identification with SIRIUS.
Dührkop K, Scheubert K, Böcker S. Dührkop K, et al. Among authors: bocker s. Metabolites. 2013 Jun 13;3(2):506-16. doi: 10.3390/metabo3020506. Metabolites. 2013. PMID: 24958003 Free PMC article.
99 results