BTK::ALGORITHMS::internal Namespace Reference


Functions

void fast_solve_3D_eigenvectors (BTK::MATH::BTKMatrix &M, double const evalues[3], BTK::MATH::BTKVector evecs[3])
void fast_solve_3D_eigenvalues (BTK::MATH::BTKMatrix const &M, double e_vals[3])
double determinant (BTK::MATH::BTKMatrix const &M)
template<typename AtomIterator1, typename AtomIterator2>
void setup_rmsd (AtomIterator1 first1, AtomIterator1 last1, AtomIterator2 first2, AtomIterator2 last2, BTK::MATH::BTKVector &T1, BTK::MATH::BTKVector &T2, BTK::MATH::BTKMatrix &R, BTK::MATH::BTKMatrix &RtR, double &Eo, unsigned &N, double &omega, double e_vals[3])


Function Documentation

double BTK::ALGORITHMS::internal::determinant ( BTK::MATH::BTKMatrix const &  M  ) 

void fast_solve_3D_eigenvalues ( BTK::MATH::BTKMatrix const &  M,
double  e_vals[3] 
)

void fast_solve_3D_eigenvectors ( BTK::MATH::BTKMatrix M,
double const   evalues[3],
BTK::MATH::BTKVector  evecs[3] 
)

void BTK::ALGORITHMS::internal::setup_rmsd ( AtomIterator1  first1,
AtomIterator1  last1,
AtomIterator2  first2,
AtomIterator2  last2,
BTK::MATH::BTKVector T1,
BTK::MATH::BTKVector T2,
BTK::MATH::BTKMatrix R,
BTK::MATH::BTKMatrix RtR,
double &  Eo,
unsigned &  N,
double &  omega,
double  e_vals[3] 
)


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