linear polymer mass spectrometry software

linear polymer mass spectrometry software

massxpert

Free

massXpert is a program to simulate and analyse mass spectrometric data obtained on linear (bio-)polymers. It is the successor of GNU polyxmass.

Four modules allow:

  • making brand new polymer chemistry definitions;
  • using the definitions to perform easy calculations in a desktop calculator-like manner;
  • performing sophisticated polymer sequence editing and simulations;
  • perform m/z list comparisons; Chemical simulations encompass cleavage (either chemical or enzymatic), gas-phase fragmentations, chemical modification of any monomer in the polymer sequence, cross-linking of monomers in the sequence, arbitrary mass searches, calculation of the isotopic pattern...

License: Open Source
Version: 3.4.1