fitModel.h File Reference

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Classes

class  BALL::QSAR::FitModel

Namespaces

namespace  BALL
namespace  BALL::QSAR

Functions

double BALL::QSAR::getFunctionValue (double X, void *params)
int BALL::QSAR::setF (const gsl_vector *x, void *params, gsl_vector *f)
int BALL::QSAR::setDf (const gsl_vector *x, void *params, gsl_matrix *df)
int BALL::QSAR::setFdf (const gsl_vector *x, void *params, gsl_vector *f, gsl_matrix *df)
gsl_multifit_function_fdf BALL::QSAR::make_fdf (int(*f)(const gsl_vector *, void *, gsl_vector *), int(*df)(const gsl_vector *, void *, gsl_matrix *), int(*fdf)(const gsl_vector *, void *, gsl_vector *, gsl_matrix *), size_t n, size_t p, void *params)

Variables

const Matrix< double > * BALL::QSAR::fitX
Matrix< double > * BALL::QSAR::fitY
String * BALL::QSAR::equation
vector< String > * BALL::QSAR::diffEquations
ParsedFunction< double > * BALL::QSAR::f
unsigned int BALL::QSAR::c
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