IsoScore: Automated localization of biotransformations by mass spectrometry using product ion scoring of virtual regioisomers

Rapid Communications in Mass Spectrometry

Volumn 23, Issue 1, 2009, Pages 39-50

  Leclercq, Laurent ^a   Mortishire Smith, Russell J ^a   Huisman, Maarten ^a   Cuyckens, Filip ^a   Hartshorn, Michael J ^b   Hill, Alastair ^b  

^a JOHNSON AND JOHNSON   (United States)

^b Dotmatics Limited   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

BIOCONVERSION; BIOMOLECULES; DIGITAL LIBRARIES; ISOMERS; MASS SPECTROMETERS; MASS SPECTROMETRY; METABOLITES;

ACCURATE MASS MEASUREMENTS; IN-SILICO; LOCALISATION; MASS SPECTRA; METABOLITE SPECTRA; PARENT COMPOUNDS; PRODUCT IONS; REGIOISOMERS; SCORING FUNCTIONS; SPECTRA'S;

IONS;

EID: 60349093978     PISSN: 09514198     EISSN: 10970231     Source Type: Journal    
DOI: 10.1002/rcm.3854     Document Type: Article

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