5 results for “topic:isotopic-distribution-calculations”
A Python implementation of Baffling Recursive Algorithm for Isotopic distributioN calculations
United Formula Annotation (UFA) for LC-HRMS data
Exhaustive Formula Annotation from ions to formula
A simplified version of the 'IDSL.UFA' package
The IPDC algorithm was developed to screen for a wide variety of organic compounds in high-resolution mass spectrometry (HRMS) data acquired from instruments with resolution power as low as 22 000 fwhm.