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Contains non-GUI classes for the modelling of linear polymer chemistries. More...
Prop instance of which the member data points to a dynamically allocated ChemicalGroup instance | |
Prop instance of which the member data points to a dynamically allocated Modif instance |
The libXpertMass module provides classes to model all the chemical entities required to fully characterize the behaviour of polymer chemistries both in solution and in the gas phase. It offers both high-level classes such as Polymer and low-level classes such as Isotope. Other classes define how polymers of a given polymer chemistry might be modified, either in solution or in the gas phase (cleavages or fragmentations).