msxpertsuite-minexpert

mass spectrometry software suite - mineXpert
  http://www.msxpertsuite.org/
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MsXpertSuite provides programs to model linear (bio-) polymer chemistries, simulate mass spectral data, analyse and data-mine mass. It is the successor of GNU polyXmass, first, and then of massXpert.

This package ships the mineXpert program.