CustomBondBend Class Reference
[User defined molecular mechanics force terms]

Abstract base class for custom bond bend functions, that is, functional forms that apply an angle-based torque between the two lines formed by a 1-2-3 triple of bonded atoms. More...

#include <DuMMForceFieldSubsystem.h>

List of all members.

Public Member Functions
virtual	~CustomBondBend ()
virtual Real	calcEnergy (Real bendAngle) const =0
virtual Real	calcTorque (Real bendAngle) const =0

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Detailed Description

Abstract base class for custom bond bend functions, that is, functional forms that apply an angle-based torque between the two lines formed by a 1-2-3 triple of bonded atoms.

See also:

DuMMForceFieldSubsystem::defineCustomBondBend()

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Constructor & Destructor Documentation

virtual ~CustomBondBend

(

)

[inline, virtual]

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

• DuMMForceFieldSubsystem.h