libxpertmassgui1

C++ mass spectrometry libraries (GUI runtime files)

Description

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:

* msXpertSuite/massXpert2;

* msXpertSuite/mineXpert2.

libXpertMass contains abstractions for all the chemical entities required to fully characterize a polymer chemistry definition, as shown below:

* 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.

libXpertMassGui contains classes useful:

* 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.

This package ships the runtime files for the libXpertMassGui library.

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Homepage

http://www.msxpertsuite.org/libxpertmass/

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