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