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#include <BALL/CONCEPT/classTest.h>
#include <BALL/QSAR/QSARData.h>
#include <BALL/QSAR/oplsModel.h>
using namespace BALL;
using namespace BALL::QSAR;
START_TEST(OPLS-model)
PRECISION(1E-7)
QSARData data;
data.readCSVFile("data/Regression_test.csv",1,1,1," ",0,0);
CHECK(PLS-model)
OPLSModel model(data);
vector<double> p;
p.push_back(1);p.push_back(1);
model.setParameters(p);
model.readTrainingData();
model.train();
const Eigen::MatrixXd* res = model.getTrainingResult();
TEST_REAL_EQUAL(res->rows(),3)
TEST_REAL_EQUAL((*res)[0],0.141237)
TEST_REAL_EQUAL((*res)[1],0.3923251)
TEST_REAL_EQUAL((*res)[2],0.5555323)
RESULT
END_TEST
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