/usr/include/BALL/QSAR/logitModel.h is in libball1.4-dev 1.4.3~beta1-4.
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1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 | // -*- Mode: C++; tab-width: 2; -*-
// vi: set ts=2:
//
//
#ifndef LOGITMODEL
#define LOGITMODEL
#ifndef CLASSIFICATION
#include <BALL/QSAR/classificationModel.h>
#endif
namespace BALL{
namespace QSAR {
/** class for logistic regression */
class BALL_EXPORT LogitModel : public ClassificationModel
{
public:
/** @name Constructors and Destructors
*/
//@{
LogitModel(const QSARData& q);
~LogitModel();
EIGEN_MAKE_ALIGNED_OPERATOR_NEW
//@}
/** @name Accessors
*/
//@{
void train();
Eigen::VectorXd predict(const vector<double>& substance, bool transform);
void saveToFile(string filename);
void readFromFile(string filename);
//@}
protected:
/** @name Attributes
*/
//@{
Eigen::MatrixXd training_result_;
//@}
};
}
}
#endif // LOGITMODEL
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