MRMD 0.4.0
Multi Resolution Molecular Dynamics
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mrmd::action::impl Namespace Reference

Classes

class  CappedLennardJonesPotential
 
class  Coulomb
 
class  CoulombDSF
 Implements the Coulomb potential with the Damped Shifted Force (DSF) method. More...
 
struct  Energy
 
class  Shake
 SHAKE algorithm (DOI: 10.1016/0021-9991(77)90098-5) RATTLE algorithm (DOI: 10.1016/0021-9991(83)90014-1) More...