Efficient calculation of accurate masses of isotopic peaks

Journal of the American Society for Mass Spectrometry

Volumn 17, Issue 3, 2006, Pages 415-419

  Rockwood, Alan L ^a   Haimi, Perttu ^b  

^a ARUP INSTITUTE FOR CLINICAL AND EXPERIMENTAL PATHOLOGY   (United States)

^b UNIVERSITY OF HELSINKI   (Finland)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; MASS SPECTROMETRY;

ACCURATE MASSES; COMPUTATIONALLY EFFICIENT; ISOTOPIC PEAKS;

MOLECULAR DYNAMICS;

ACCURACY; ARTICLE; CALCULATION; ISOTOPE ANALYSIS; MASS SPECTROMETRY; MOLECULAR WEIGHT; MOLECULE; PROBABILITY;

ALGORITHMS; COMPUTER SIMULATION; MASS SPECTROMETRY; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR WEIGHT; RADIOISOTOPES; REPRODUCIBILITY OF RESULTS; SENSITIVITY AND SPECIFICITY;

EID: 33344474199     PISSN: 10440305     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jasms.2005.12.001     Document Type: Article

References (7)

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3. S.G. Roussis, R. Prouix Reduction of Chemical Formulas from the Isotopic Peak Distributions of High-Resolution Mass Spectra Anal. Chem. 75 2003 1470 1482
4. A.L. Rockwood, S.L. Van Orden, R.D. Smith Rapid Calculation of Isotope Distributions Anal. Chem. 67 1995 2699 2704
5. J.A. Yergey A General Approach to Calculating Isotopic Distributions for Mass Spectrometry Int. J. Mass Spectrom. Ion Phys. 52 1983 337 349
6. A.L. Rockwood, J.R. Van Orman, D.V. Dearden Isotopic Composition and Exact Masses of Single Isotopic Peaks J. Am. Soc. Mass Spectrom. 15 2004 12 21
7. n J. Am. Soc. Mass Spectrom. 14 2003 311 322