Computing Fragmentation Trees from Metabolite Multiple Mass Spectrometry Data

Computing Fragmentation Trees from Tandem Mass Spectrometry Data

(2010) Florian Rasche et al.   ANALYTICAL CHEMISTRY

On the inter-instrument and inter-laboratory transferability of a tandem mass spectral reference library: 1. Results of an Austrian multicenter study

(2009) Herbert Oberacher et al.   JOURNAL OF MASS SPECTROMETRY

On the inter-instrument and the inter-laboratory transferability of a tandem mass spectral reference library: 2. Optimization and characterization of the search algorithm

(2009) Herbert Oberacher et al.   JOURNAL OF MASS SPECTROMETRY

In silicomethods for predicting metabolism and mass fragmentation applied to quetiapine in liquid chromatography/time-of-flight mass spectrometry urine drug screening

(2009) Anna Pelander et al.   RAPID COMMUNICATIONS IN MASS SPECTROMETRY

Mass Spectral Metabonomics beyond Elemental Formula: Chemical Database Querying by Matching Experimental with Computational Fragmentation Spectra

(2008) Dennis W. Hill et al.   ANALYTICAL CHEMISTRY

Multi-spectra peptide sequencing and its applications to multistage mass spectrometry

(2008) N. Bandeira et al.   BIOINFORMATICS

Towards de novo identification of metabolites by analyzing tandem mass spectra

(2008) S. Bocker et al.   BIOINFORMATICS

Determination of ion structures in structurally related compounds using precursor ion fingerprinting

(2008) Michelle T. Sheldon et al.   JOURNAL OF THE AMERICAN SOCIETY FOR MASS SPECTROMETRY

FiD: a software forab initiostructural identification of product ions from tandem mass spectrometric data

(2008) Markus Heinonen et al.   RAPID COMMUNICATIONS IN MASS SPECTROMETRY