IMP::modeller::MultipleBinormalRestraint Class Reference

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Detailed Description

Modeller-style multiple binormal (phi/psi) restraint.

This implements a multiple binormal restraint on the two dihedral angles between the two quads of Particles passed to the restraint, by implementing equation A.76 in the Modeller manual. The two angles are typically the phi and psi dihedrals of a residue.

Inheritance diagram for IMP::modeller::MultipleBinormalRestraint:

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Public Member Functions
void	add_term (const BinormalTerm &term)
	Add a single BinormalTerm to the restraint.
ContainersTemp	get_input_containers () const
ParticlesTemp	get_input_particles () const
ParticlesList	get_interacting_particles () const
virtual std::string	get_type_name () const
virtual ::IMP::VersionInfo	get_version_info () const
	MultipleBinormalRestraint (const ParticleQuad &q1, const ParticleQuad &q2)
	Create the multiple binormal restraint.
virtual double	unprotected_evaluate (DerivativeAccumulator *accum) const
Friends
template<class T >
void	IMP::internal::unref (T *)

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Constructor & Destructor Documentation

IMP::modeller::MultipleBinormalRestraint::MultipleBinormalRestraint	(	const ParticleQuad &	q1,
		const ParticleQuad &	q2
	)

Create the multiple binormal restraint.

After creating the restraint, call add_term one or more times to add BinormalTerms to the restraint.

Parameters:

[in]	q1	First quad of particles.
[in]	q2	Second quad of particles.

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

• MultipleBinormalRestraint.h
• modeller/__init__.py