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IMP Reference Guide  develop.45c11de31d,2024/03/27
The Integrative Modeling Platform
IMP::kinematics::CCDLoopClosure Class Reference

CCD loop closure. More...

#include <IMP/kinematics/CCDLoopClosure.h>

Detailed Description

CCD loop closure.

see Canutescu and Dunbrack, Protein Science

Definition at line 22 of file CCDLoopClosure.h.

Public Member Functions

 CCDLoopClosure (DihedralAngleRevoluteJoints joints, const algebra::Vector3D &F1, const algebra::Vector3D &F2, const algebra::Vector3D &F3, core::XYZ M1, core::XYZ M2, core::XYZ M3)
 Constructor. More...
 
bool close_loop ()
 

Constructor & Destructor Documentation

IMP::kinematics::CCDLoopClosure::CCDLoopClosure ( DihedralAngleRevoluteJoints  joints,
const algebra::Vector3D F1,
const algebra::Vector3D F2,
const algebra::Vector3D F3,
core::XYZ  M1,
core::XYZ  M2,
core::XYZ  M3 
)

Constructor.

F1-3 are the target points for closed loop M1-3 are the points in the model


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