These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.
193 related articles for article (PubMed ID: 21678983)
1. Applying in-silico retention index and mass spectra matching for identification of unknown metabolites in accurate mass GC-TOF mass spectrometry. Kumari S; Stevens D; Kind T; Denkert C; Fiehn O Anal Chem; 2011 Aug; 83(15):5895-902. PubMed ID: 21678983 [TBL] [Abstract][Full Text] [Related]
2. Evaluation of an Artificial Neural Network Retention Index Model for Chemical Structure Identification in Nontargeted Metabolomics. Samaraweera MA; Hall LM; Hill DW; Grant DF Anal Chem; 2018 Nov; 90(21):12752-12760. PubMed ID: 30350614 [TBL] [Abstract][Full Text] [Related]
3. How searching against multiple libraries can lead to biased results in GC/MS-based metabolomics. Samokhin AS; Matyushin DD Rapid Commun Mass Spectrom; 2023 Feb; 37(3):e9437. PubMed ID: 36409456 [TBL] [Abstract][Full Text] [Related]
5. FiehnLib: mass spectral and retention index libraries for metabolomics based on quadrupole and time-of-flight gas chromatography/mass spectrometry. Kind T; Wohlgemuth G; Lee DY; Lu Y; Palazoglu M; Shahbaz S; Fiehn O Anal Chem; 2009 Dec; 81(24):10038-48. PubMed ID: 19928838 [TBL] [Abstract][Full Text] [Related]
6. GCMS-ID: a webserver for identifying compounds from gas chromatography mass spectrometry experiments. Wakoli J; Anjum A; Sajed T; Oler E; Wang F; Gautam V; LeVatte M; Wishart DS Nucleic Acids Res; 2024 Jul; 52(W1):W381-W389. PubMed ID: 38783107 [TBL] [Abstract][Full Text] [Related]
7. Identification of terpenoids from Ephedra combining with accurate mass and in-silico retention indices. He M; Yan J; Cao D; Liu S; Zhao C; Liang Y; Li Y; Zhang Z Talanta; 2013 Jan; 103():116-22. PubMed ID: 23200366 [TBL] [Abstract][Full Text] [Related]
9. [Development of a widely-targeted metabolomics method based on gas chromatography-mass spectrometry]. Wang YT; Yang Y; Sun XL; Ji J Se Pu; 2023 Jun; 41(6):520-526. PubMed ID: 37259877 [TBL] [Abstract][Full Text] [Related]
10. Fragment formula calculator (FFC): determination of chemical formulas for fragment ions in mass spectrometric data. Wegner A; Weindl D; Jäger C; Sapcariu SC; Dong X; Stephanopoulos G; Hiller K Anal Chem; 2014 Feb; 86(4):2221-8. PubMed ID: 24498896 [TBL] [Abstract][Full Text] [Related]
11. Using Accurate Mass Gas Chromatography-Mass Spectrometry with the MINE Database for Epimetabolite Annotation. Lai Z; Kind T; Fiehn O Anal Chem; 2017 Oct; 89(19):10171-10180. PubMed ID: 28876899 [TBL] [Abstract][Full Text] [Related]
12. Annotation of metabolites from gas chromatography/atmospheric pressure chemical ionization tandem mass spectrometry data using an in silico generated compound database and MetFrag. Ruttkies C; Strehmel N; Scheel D; Neumann S Rapid Commun Mass Spectrom; 2015 Aug; 29(16):1521-9. PubMed ID: 26212167 [TBL] [Abstract][Full Text] [Related]
13. Quantum Chemical Prediction of Electron Ionization Mass Spectra of Trimethylsilylated Metabolites. Wang S; Kind T; Bremer PL; Tantillo DJ; Fiehn O Anal Chem; 2022 Jan; 94(3):1559-1566. PubMed ID: 35006668 [TBL] [Abstract][Full Text] [Related]
14. Automated procedure for candidate compound selection in GC-MS metabolomics based on prediction of Kovats retention index. Mihaleva VV; Verhoeven HA; de Vos RC; Hall RD; van Ham RC Bioinformatics; 2009 Mar; 25(6):787-94. PubMed ID: 19176550 [TBL] [Abstract][Full Text] [Related]
15. Automatic Assignment of Molecular Ion Species to Elemental Formulas in Gas Chromatography/Methane Chemical Ionization Accurate Mass Spectrometry. Wang S; Valdiviez L; Ye H; Fiehn O Metabolites; 2023 Aug; 13(8):. PubMed ID: 37623905 [TBL] [Abstract][Full Text] [Related]
16. Determination of elemental compositions by gas chromatography/time-of-flight mass spectrometry using chemical and electron ionization. Abate S; Ahn YG; Kind T; Cataldi TR; Fiehn O Rapid Commun Mass Spectrom; 2010 Apr; 24(8):1172-80. PubMed ID: 20301109 [TBL] [Abstract][Full Text] [Related]
17. Mass spectral fragmentation of trimethylsilylated small molecules. Lai Z; Fiehn O Mass Spectrom Rev; 2018 May; 37(3):245-257. PubMed ID: 27580014 [TBL] [Abstract][Full Text] [Related]
19. Automated Annotation and Evaluation of In-Source Mass Spectra in GC/Atmospheric Pressure Chemical Ionization-MS-Based Metabolomics. Jaeger C; Hoffmann F; Schmitt CA; Lisec J Anal Chem; 2016 Oct; 88(19):9386-9390. PubMed ID: 27584561 [TBL] [Abstract][Full Text] [Related]
20. Seven Golden Rules for heuristic filtering of molecular formulas obtained by accurate mass spectrometry. Kind T; Fiehn O BMC Bioinformatics; 2007 Mar; 8():105. PubMed ID: 17389044 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]