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5 #ifndef BALL_QSAR_CONFIGIO_H
6 #define BALL_QSAR_CONFIGIO_H
8 #ifndef BALL_DATATYPE_STRING_H
157 #endif // BALL_QSAR_CONFIGIO_H
InputPartitioningConfiguration()
double quality_increase_cutoff
vector< String > csv_separator
static InputPartitioningConfiguration readInputPartitioningConfiguration(std::istream *input)
static FeatureSelectionConfiguration readFeatureSelectionConfiguration(std::istream *input)
static ModelConfiguration readModelConfiguration(std::istream *input)
static void putbackLine(std::istream *input, String &line)
double validation_fraction
FeatureSelectionConfiguration()
static PredictionConfiguration readPredictionConfiguration(std::istream *input)
vector< bool > csv_compound_labels
bool for_visualization_only
static ValidationConfiguration readValidationConfiguration(std::istream *input)
ValidationConfiguration()
std::set< String > activity_names
vector< String > external_predictions
bool nonnumeric_class_names
double grid_search_stepwidth
static InputConfiguration readInputConfiguration(std::istream *input)
bool separate_activity_file
double grid_search_stepwidth
std::multiset< int > activities
vector< String > csv_file
vector< int > csv_no_response
String descriptor_source_model
vector< double > model_parameters
bool optimize_model_parameters
vector< bool > csv_desc_labels
int grid_search_recursions
PredictionConfiguration()
double validation_fraction
int no_of_permutation_tests
int grid_search_recursions