BALL  1.5.0
linearModel.h
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1 // -*- Mode: C++; tab-width: 2; -*-
2 // vi: set ts=2:
3 //
4 //
5 
6 #ifndef LMODEL
7 #define LMODEL
8 
9 #ifndef REGRESSION
11 #endif
12 
13 namespace BALL
14 {
15  namespace QSAR
16  {
18  {
19 
20  public:
26  LinearModel(const QSARData& q);
27 
29 
30  virtual void operator=(const LinearModel& m);
31 
33 
34 
38  virtual Eigen::VectorXd predict(const vector<double>& substance, bool transform=1);
39 
40  protected:
43  };
44  }
45 }
46 
47 #endif // LMODEL
BALL_EXPORT
#define BALL_EXPORT
Definition: COMMON/global.h:50
BALL::QSAR::RegressionModel
Definition: regressionModel.h:21
BALL::QSAR::LinearModel::predict
virtual Eigen::VectorXd predict(const vector< double > &substance, bool transform=1)
BALL
Definition: constants.h:13
BALL::QSAR::QSARData
Definition: QSARData.h:56
BALL::QSAR::LinearModel::calculateOffsets
void calculateOffsets()
BALL::QSAR::LinearModel
Definition: linearModel.h:18
regressionModel.h
BALL::QSAR::LinearModel::operator=
virtual void operator=(const LinearModel &m)
BALL::QSAR::LinearModel::~LinearModel
~LinearModel()
BALL::QSAR::LinearModel::LinearModel
LinearModel(const QSARData &q)