massxpert2
polymer chemistry modelling and mass spectrometry data simulation (runtime)
Description
massXpert2 allows the user to perform the following tasks: - Make brand new polymer chemistry definitions;
- Use the definitions to easily perform calculations in a desktop
calculator-like manner;
- Perform sophisticated polymer sequence editing and simulations;
- Perform m/z list comparisons;
- Perform isotopic cluster simulations.
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...
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