backup_data_ | BALL::QSAR::RegressionValidation | private |
backupTrainingResults() | BALL::QSAR::RegressionValidation | private |
bootstrap(int k, bool restore=1) | BALL::QSAR::RegressionValidation | virtual |
bootstrap(int k, vector< BALL::Matrix< double > > *results, bool restore=1) | BALL::QSAR::RegressionValidation | |
bootstrap1(int k, vector< BALL::Matrix< double > > *results, bool restore=1) | BALL::QSAR::RegressionValidation | |
calculateCoefficientStdErrors(int k, bool b=1) | BALL::QSAR::RegressionValidation | |
calculateQOF() | BALL::QSAR::RegressionValidation | private |
coefficient_stderr_ | BALL::QSAR::RegressionValidation | private |
crossValidation(int k, bool restore=1) | BALL::QSAR::RegressionValidation | virtual |
crossValidation(int k, vector< BALL::Matrix< double > > *results, bool restore=1) | BALL::QSAR::RegressionValidation | |
F_cv_ | BALL::QSAR::RegressionValidation | private |
F_regr_ | BALL::QSAR::RegressionValidation | private |
fitQualFetcher_ | BALL::QSAR::RegressionValidation | private |
getCoefficientStdErrors() | BALL::QSAR::RegressionValidation | |
getCVRes() | BALL::QSAR::RegressionValidation | virtual |
getFcv() | BALL::QSAR::RegressionValidation | |
getFitRes() | BALL::QSAR::RegressionValidation | virtual |
getFregr() | BALL::QSAR::RegressionValidation | |
getMaxError() | BALL::QSAR::RegressionValidation | |
getQ2() | BALL::QSAR::RegressionValidation | |
getR2() | BALL::QSAR::RegressionValidation | |
getStat() const | BALL::QSAR::Validation | |
getYRandResults() const | BALL::QSAR::Validation | |
max_error_ | BALL::QSAR::RegressionValidation | private |
model_ | BALL::QSAR::Validation | protected |
predQualFetcher_ | BALL::QSAR::RegressionValidation | private |
Q2_ | BALL::QSAR::RegressionValidation | private |
qualCalculation | BALL::QSAR::RegressionValidation | private |
quality_ | BALL::QSAR::RegressionValidation | private |
R2_ | BALL::QSAR::RegressionValidation | private |
readFromFile(string filename) | BALL::QSAR::RegressionValidation | virtual |
regr_model_ | BALL::QSAR::RegressionValidation | private |
RegressionValidation(RegressionModel *m) | BALL::QSAR::RegressionValidation | |
restoreTrainingResults() | BALL::QSAR::RegressionValidation | private |
saveToFile(string filename) const | BALL::QSAR::RegressionValidation | virtual |
saveToFile(string filename, const double &r2, const double &q2, const Matrix< double > &coefficient_stddev, const Matrix< double > &yRand_results) const | BALL::QSAR::RegressionValidation | |
selectStat(int s) | BALL::QSAR::RegressionValidation | virtual |
setCoefficientStdErrors(const BALL::Matrix< double > *stddev) | BALL::QSAR::RegressionValidation | |
setCVRes(double d) | BALL::QSAR::RegressionValidation | virtual |
setQ2(double d) | BALL::QSAR::RegressionValidation | |
setTestLine(int test_line, int current_line, bool back_transform=0) | BALL::QSAR::Validation | protected |
setTrainingLine(int train_line, int current_line) | BALL::QSAR::Validation | protected |
ssE_ | BALL::QSAR::RegressionValidation | private |
ssR_ | BALL::QSAR::RegressionValidation | private |
ssY_ | BALL::QSAR::RegressionValidation | private |
std_err_ | BALL::QSAR::RegressionValidation | private |
substances_names_ | BALL::QSAR::Validation | protected |
test_substances_ | BALL::QSAR::Validation | protected |
test_Y_ | BALL::QSAR::Validation | protected |
testAllSubstances(bool transform) | BALL::QSAR::RegressionValidation | private |
testInputData(bool transform=0) | BALL::QSAR::RegressionValidation | virtual |
Validation(Model *m) | BALL::QSAR::Validation | |
validation_statistic_ | BALL::QSAR::Validation | protected |
yRand() | BALL::QSAR::Validation | protected |
yRand_results_ | BALL::QSAR::Validation | protected |
yRandomizationTest(int runs, int k) | BALL::QSAR::RegressionValidation | virtual |
~RegressionValidation() | BALL::QSAR::RegressionValidation | |
~Validation() | BALL::QSAR::Validation | virtual |