msxpertsuite 3.7.0-1 (i386 binary) in ubuntu bionic

 msXpertSuite is a collection of programs to simulate and analyse mass
 spectrometric data obtained on linear (bio-)polymers. It is the
 successor of GNU polyXmass, first, and of massXpert, second.
 .
 Three programs, massXpert, mineXpert and convXpert allow the following:
 .
 massXpert:
  - 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...
 .
 mineXpert:
  - Open mass spectrometry data files (mzML, mzXML, asc, xy, ...);
  - Calculate and display the TIC chromatogram;
  - For mobility data, calculate and display a mz=f(dt) color map;
  - Integrate the data from the TIC chromatogram or color map
    - to mass spectrum;
    - to drift spectrum;
    - back to TIC chromatogram (XIC chromatogram);
    - reverse operations;
  - Export the data to text files;
  - Slice a big initial file into smaller chunks for easier mining;
  - Define how mining activity is recorded on disk for later use;
  - Convert mzML files into a private (albeit open) mass spectrometry
    format that allows better performance (based on SQLite3).
 .
 This package contains the binary programs.

Details

Package version:
3.7.0-1
Source:
msxpertsuite 3.7.0-1 source package in Ubuntu
Status:
Superseded
Component:
universe
Priority:
Optional