Testing an alternative search algorithm for compound identification with the 'Wiley Registry of Tandem Mass Spectral Data, MSforID'.

scientific article

Testing an alternative search algorithm for compound identification with the 'Wiley Registry of Tandem Mass Spectral Data, MSforID'. is …
instance of (P31):
scholarly articleQ13442814

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P356DOI10.1002/JMS.3185
P698PubMed publication ID23584943

P2093author name stringHerbert Oberacher
Wolfgang Weinmann
Bernd Berger
Graeme Whitley
P2860cites workMetabolite Identification Using Automated Comparison of High-Resolution Multistage Mass Spectral TreesQ27156570
Identifying the Unknowns by Aligning Fragmentation TreesQ28530233
METLIN: a metabolite mass spectral databaseQ29614808
Poor reproducibility of in-source collisional atmospheric pressure ionization mass spectra of toxicologically relevant drugsQ30832978
LC-MS/MS systematic toxicological analysis: comparison of MS/MS spectra obtained with different instruments and settingsQ31153598
Creation and comparison of MS/MS spectral libraries using quadrupole ion trap and triple-quadrupole mass spectrometersQ33200547
Comparison of product ion spectra obtained by liquid chromatography/triple-quadrupole mass spectrometry for library searchQ33203037
Screening of drugs and toxic compounds with liquid chromatography-linear ion trap tandem mass spectrometryQ33251285
Combined use of ESI-QqTOF-MS and ESI-QqTOF-MS/MS with mass-spectral library search for qualitative analysis of drugsQ33253322
Towards a universal product ion mass spectral library - reproducibility of product ion spectra across eleven different mass spectrometersQ33333576
Determination of ion structures in structurally related compounds using precursor ion fingerprintingQ33388023
On the inter-instrument and the inter-laboratory transferability of a tandem mass spectral reference library: 2. Optimization and characterization of the search algorithmQ33400813
On the inter-instrument and inter-laboratory transferability of a tandem mass spectral reference library: 1. Results of an Austrian multicenter study.Q33402532
Evaluation of the performance of a tandem mass spectral library with mass spectral data extracted from literatureQ33452095
X-Rank: a robust algorithm for small molecule identification using tandem mass spectrometryQ33496217
ESI-MS/MS library of 1,253 compounds for application in forensic and clinical toxicologyQ33504652
Comprehensive identification of active compounds in tablets by flow-injection data-dependent tandem mass spectrometry combined with library searchQ33526122
Development and practical application of a library of CID accurate mass spectra of more than 2,500 toxic compounds for systematic toxicological analysis by LC-QTOF-MS with data-dependent acquisitionQ33762355
Computing fragmentation trees from tandem mass spectrometry dataQ33779369
Quality evaluation of tandem mass spectral librariesQ33835921
Evaluation of the comparability of spectra generated using a tuning point protocol on twelve electrospray ionisation tandem-in-space mass spectrometersQ33858505
Drugs of abuse screening in urine as part of a metabolite-based LC-MSn screening conceptQ33887048
On the inter-instrument and the inter-laboratory transferability of a tandem mass spectral reference library. 3. Focus on ion trap and upfront CID.Q34167752
Estimating probabilities of correct identification from results of mass spectral library searchesQ35039953
Information-dependent acquisition-mediated LC-MS/MS screening procedure with semiquantitative potential.Q49129681
P433issue4
P304page(s)497-504
P577publication date2013-04-01
P1433published inJournal of Mass SpectrometryQ3014050
P1476titleTesting an alternative search algorithm for compound identification with the 'Wiley Registry of Tandem Mass Spectral Data, MSforID'.
P478volume48

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cites work (P2860)
Q105264586A European proposal for quality control and quality assurance of tandem mass spectral libraries
Q115888795Advanced analytical and informatic strategies for metabolite annotation in untargeted metabolomics
Q61813879Annotating Nontargeted LC-HRMS/MS Data with Two Complementary Tandem Mass Spectral Libraries
Q35389892Applying 'Sequential Windowed Acquisition of All Theoretical Fragment Ion Mass Spectra' (SWATH) for systematic toxicological analysis with liquid chromatography-high-resolution tandem mass spectrometry
Q35840290Compound identification in forensic toxicological analysis with untargeted LC-MS-based techniques.
Q29994570Identification of small molecules using accurate mass MS/MS search
Q111804016In silico deconjugation of glucuronide conjugates enhances tandem mass spectra library annotation of human samples
Q50561597SANIST: optimization of a technology for compound identification based on the European Union directive with applications in forensic, pharmaceutical and food analyses.
Q35899374Successful adaption of a forensic toxicological screening workflow employing nontargeted liquid chromatography-tandem mass spectrometry to water analysis.

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