Simpatico
v1.10
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Classes that model atoms, groups, molecules, and species.
Classes | |
struct | Tools::Atom |
A point particle in an MD simulation. More... | |
class | Tools::Group< N > |
A group of covalently interacting atoms. More... | |
class | Tools::Molecule |
An Molecule has a sequence of atoms, and belongs to an Species. More... | |
class | Tools::Species |
A set of identical molecules. More... | |