massXpert mass spectrometry package 1.7.2 (Default branch) |
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The massXpert software package is a mass
spectrometry environment for linear
(bio-)polymers. It inherits all the innovations of
GNU polyxmass. It allows the detailed definition
of new polymer chemistries in the XpertDef module.
These chemistry definitions are then used in the
desktop calculator-like mass calculator
(XpertCalc) and in the sophisticated polymer
sequence editor and (bio-)chemical/mass
spectrometric simulations module (XpertEdit).
Available simulations include polymer and monomer
chemical modifications, polymer sequence cleavage,
gas-phase fragmentation, m/z ratio calculations,
and more.
License: GNU General Public License (GPL)
Changes:
Dynamic filtering of the oligomer data obtained
after a polymer sequence cleavage was added. This
allows an immediate scrutiny of the obtained
oligomers when these are numerous and one
experimental mass peak needs to be interpreted.
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