sc::NonlinearTransform(3) MPQC sc::NonlinearTransform(3)NAME
sc::NonlinearTransform - The NonlinearTransform class transforms between two nonlinear coordinate systems.SYNOPSIS
#include <transform.h> Inherits sc::RefCount. Inherited by sc::IdentityTransform. Public Member Functions virtual void transform_coordinates (const RefSCVector &x)=0 Transform the coordinates. virtual void transform_gradient (const RefSCVector &g) Transform the gradient at a point in the new coordinate system. virtual void transform_hessian (const RefSymmSCMatrix &h) Transform the hessian to the new coordinate system. virtual void transform_ihessian (const RefSymmSCMatrix &ih) Transform the inverse of the hessian. Protected Attributes RefSCMatrix linear_transform_ Additional Inherited Members Detailed Description The NonlinearTransform class transforms between two nonlinear coordinate systems. It is needed when a change of coordinates occurs in the middle of an optimization. Member Function Documentation virtual void sc::NonlinearTransform::transform_gradient (const RefSCVector & g) [virtual] Transform the gradient at a point in the new coordinate system. transform_coordinates must be called first to give the point. Reimplemented in sc::IdentityTransform. virtual void sc::NonlinearTransform::transform_hessian (const RefSymmSCMatrix & h) [virtual] Transform the hessian to the new coordinate system. transform_gradient must be called first to initialize this routine. Reimplemented in sc::IdentityTransform. virtual void sc::NonlinearTransform::transform_ihessian (const RefSymmSCMatrix & ih) [virtual] Transform the inverse of the hessian. transform_gradient must be called first to initialize this routine. Reimplemented in sc::IdentityTransform. Author Generated automatically by Doxygen for MPQC from the source code. Version 2.3.1 Fri Feb 19 2016 sc::NonlinearTransform(3)