Simpatico
v1.10
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A System is a set of interacting Molecules enclosed by a Boundary.
The McSystem and MdSystem subclasses provide functions that complete the types of energy and force calculations required by MC and MD simulations, respectively.
Classes | |
class | McMd::McSystem |
A System for use in a Markov chain Monte Carlo simulation. More... | |
class | McMd::McSystemInterface |
An interface to an McSystem. More... | |
class | McMd::MdSystem |
A System for Molecular Dynamics simulation. More... | |
class | McMd::MdSystemInterface |
An interface to an MdSystem. More... | |
class | McMd::System |
A set of interacting Molecules enclosed by a Boundary. More... | |
class | McMd::SystemInterface |
An interface to a System. More... | |