Scine::Swoose  2.1.0
This is the SCINE module Swoose.
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Scine::MolecularMechanics::Repulsion Class Reference

Class treating a repulsive non-bonded interaction, based solely on the bond length. (i.e. in 1 dimension) More...

#include <Repulsion.h>

Collaboration diagram for Scine::MolecularMechanics::Repulsion:
Collaboration graph

Public Member Functions

 Repulsion (double scalingFactor)
 
Utils::AutomaticDifferentiation::Second1D getInteraction (const double &bondLength, const double &effectiveChargeA, const double &effectiveChargeB, const double &betaRepulsion, const double &R0) const
 

Public Attributes

double scalingFactor_
 

Detailed Description

Class treating a repulsive non-bonded interaction, based solely on the bond length. (i.e. in 1 dimension)

The documentation for this class was generated from the following files: