The manuscripts "Evaluation of the Sensitivity of the “Wiley Registry of Tandem Mass Spectral Data, MSforID” with the “NIST/NIH/EPA Mass Spectral Library”” (H. Oberacher, G. Whitley, B. Berger) and "Testing an Alternative Search Algorithm for Compound Identification with the “Wiley Registry of Tandem Mass Spectral Data, MSforID”” (H. Oberacher, G. Whitley, B. Berger, W. Weinmann) have been published in Journal of Mass Spectrometry.
[Read More]Systematic toxicological analysis
The manuscript "Identification of Drugs and Toxicants in Human Body Fluids by LC-MS/MS under Data-dependent Acquisition Control and Automated Database Search" (H. Oberacher, B. Schubert, K. Libiseller, A. Schweissgut) has been published in Analytica Chimica Acta.
[Read More]Validation of the library with published spectra
The manuscript “Evaluation of the Performance of a Tandem Mass Spectral Library with Mass Spectral Data Extracted from Literature.” (P. Würtinger, H. Oberacher) has been published in Drug Testing and Analysis.
[Read More]New paper on the transferability of the library
The manuscript “On the Inter-instrument and the Inter-laboratory Transferability of a Tandem Mass Spectral Reference Library. 3. Focus on Ion Trap and Up-front CID.” (H. Oberacher, F. Pitterl, E. Siapi, B. R. Steele, T. Letzel, S. Grosse, B. Poschner, F. Tagliaro, R. Gottardo, S. A. Chacko, J. L. Josephs) has been published in Journal of Mass Spectrometry.
In the paper we have demonstrated with spectra obtained from ion trap and up-front CID instruments that the library represents a reliable and robust identification tool.
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Performance evaluation of the MSforID library
The manuscript “Quality Evaluation of Tandem Mass Spectral Libraries.” (H. Oberacher, S. Dresen, W. Weinmann) has been published in Analytical and Bioanalytical Chemistry.
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