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automaticModelCreator.h
Go to the documentation of this file.
#include <BALL/COMMON/global.h>
#include <BALL/QSAR/Model.h>
#include <BALL/QSAR/QSARData.h>
namespace BALL
{
namespace QSAR
{
class BALL_EXPORT AutomaticModelCreator
{
public:
AutomaticModelCreator(const QSARData* data);
Model* generateModel();
void setData(const QSARData* data);
void setMinQuality(double min_quality);
private:
void optimizeParameters(Model* model);
void selectFeatures(Model* model);
const QSARData* data_;
double min_quality_;
};
}
}
global.h
BALL_EXPORT
#define BALL_EXPORT
Definition COMMON/global.h:50
Model.h
QSARData.h
BALL::QSAR::AutomaticModelCreator::AutomaticModelCreator
AutomaticModelCreator(const QSARData *data)
BALL::QSAR::AutomaticModelCreator::generateModel
Model * generateModel()
BALL::QSAR::AutomaticModelCreator::setMinQuality
void setMinQuality(double min_quality)
BALL::QSAR::AutomaticModelCreator::setData
void setData(const QSARData *data)
BALL::QSAR::Model
Definition Model.h:35
BALL::QSAR::QSARData
Definition QSARData.h:56
BALL::QSAR
Definition allModel.h:17
BALL
Definition constants.h:13