libxpertmass1 - 1.1.0-1 main

The libXpertMass and the libXpertMassGui shared libraries are designed
to enshrine the non-GUI and the GUI functionalities needed by the
following two mass spectrometry projects:
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* msXpertSuite/massXpert2;
* msXpertSuite/mineXpert2.
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libXpertMass contains abstractions for all the chemical entities required
to fully characterize a polymer chemistry definition, as shown below:
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* Isotope
* IsotopicData
* Formula
* Monomer
* Oligomer
* Polymer
* Modif
* CrossLinker
* CrossLink
* Aqueous chemical reactions (cleavages, enzymatic and non-enzymatic)
* Gas-phase chemical reactions (fragmentations, with a sophisticated
grammar to describe complex fragmentation patterns)
* Isotopic cluster modelling/calculations for any chemical entity
representable by an element composition formula and a charge.
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libXpertMassGui contains classes useful:
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* to display and manage isotopic data,
* to configure isotopic cluster calculations,
* to configure mass peak shaping processes (GAUSSIAN and LORENTZIAN),
* to configure network communications between massXpert2 and mineXpert2.
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This package ships the runtime files for the libXpertMass library.