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Background: IDCalc was developed to provide a simple way to view the expected isotope distribution for biological molecules measured by mass spectrometry. The program also includes the the ability to consider enriched stable isotopes. Input: Input is either as a peptide sequence or an elemental composition through the graphical user interface. Method: The algorithm for predicting the isotope distribution is based on the approach reported by Kubinyi, Analytica Chimica Acta, 247 (1991) 107-119. The C, H, O, and N isotope abundances are specific to biological molecules (Dwight E. Matthews personal communication). All other elemental isotope abundances were obtained from Biemann, Mass Spectrometry, Organic Chemical Applications, McGraw-Hill New York, 1962, p.59 Availability: IDCalc is free for non-profit use.

Source code is available upon request. IDCalc is academic software and is use at your own risk. Platform: IDCalc has been tested using Microsoft Windows XP and Vista. Note: You might need to install the latest version of the Visual Basic 6 Run Time first before the executable will run on your computer. Go to download the latest VB6 Run Time libraries from Microsoft. Also, on Windows 7 I have found that you have to register the COMDLG32.OCX library. You can do this by running 'regsvr32 C: SWTOOLS Apps MMCfto System32 Redist MS System COMDLG32.OCX' Download: Screenshot: IDCalc is Copyright © 2008 University of Washington.