Computer-aided interpretation of mass spectra. Increased information from neutral loss data

Autor:	Fred W. McLafferty, Rengachari. Venkataraghavan, Henry E. Dayringer
Rok vydání:	1976
Předmět:	Polyatomic ion Analytical chemistry Biochemistry Interpretation (model theory) Homologous series chemistry.chemical_compound Data class chemistry Computer-aided Mass spectrum Molecular Medicine Statistical physics Instrumentation Spectroscopy
Zdroj:	Organic Mass Spectrometry. 11:895-900
ISSN:	1096-9888 0030-493X
DOI:	10.1002/oms.1210110816
Popis:	The performance of the [Self-Training Interpretive and Retrieval System] for unknown mass spectra has been improved by modifications to the data classes utilizing information concerning the masses of neutral fragments lost from the molecular ion. Modifications include use of overlapping mass ranges, sets of homologous series of losses and an arithmetic combination of the data class rankings to give an [overall match-factor] for neutral loss data.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::a8b9a95a5b42e240f05b758396a9fc31 https://doi.org/10.1002/oms.1210110816 Zobrazit plný text záznamu Plný text