qsprpred.data package
Subpackages
- qsprpred.data.chem package
- Submodules
- qsprpred.data.chem.clustering module
- qsprpred.data.chem.matching module
- qsprpred.data.chem.scaffolds module
- qsprpred.data.chem.standardization module
- qsprpred.data.chem.tests module
TestClusters
TestClusters.addClassCleanup()
TestClusters.addCleanup()
TestClusters.addTypeEqualityFunc()
TestClusters.assertAlmostEqual()
TestClusters.assertCountEqual()
TestClusters.assertDictEqual()
TestClusters.assertEqual()
TestClusters.assertFalse()
TestClusters.assertGreater()
TestClusters.assertGreaterEqual()
TestClusters.assertIn()
TestClusters.assertIs()
TestClusters.assertIsInstance()
TestClusters.assertIsNone()
TestClusters.assertIsNot()
TestClusters.assertIsNotNone()
TestClusters.assertLess()
TestClusters.assertLessEqual()
TestClusters.assertListEqual()
TestClusters.assertLogs()
TestClusters.assertMultiLineEqual()
TestClusters.assertNoLogs()
TestClusters.assertNotAlmostEqual()
TestClusters.assertNotEqual()
TestClusters.assertNotIn()
TestClusters.assertNotIsInstance()
TestClusters.assertNotRegex()
TestClusters.assertRaises()
TestClusters.assertRaisesRegex()
TestClusters.assertRegex()
TestClusters.assertSequenceEqual()
TestClusters.assertSetEqual()
TestClusters.assertTrue()
TestClusters.assertTupleEqual()
TestClusters.assertWarns()
TestClusters.assertWarnsRegex()
TestClusters.clearGenerated()
TestClusters.countTestCases()
TestClusters.createLargeMultitaskDataSet()
TestClusters.createLargeTestDataSet()
TestClusters.createSmallTestDataSet()
TestClusters.createTestDataSetFromFrame()
TestClusters.debug()
TestClusters.defaultTestResult()
TestClusters.doClassCleanups()
TestClusters.doCleanups()
TestClusters.enterClassContext()
TestClusters.enterContext()
TestClusters.fail()
TestClusters.failureException
TestClusters.getAllDescriptors()
TestClusters.getBigDF()
TestClusters.getDataPrepGrid()
TestClusters.getDefaultCalculatorCombo()
TestClusters.getDefaultPrep()
TestClusters.getPrepCombos()
TestClusters.getSmallDF()
TestClusters.id()
TestClusters.longMessage
TestClusters.maxDiff
TestClusters.run()
TestClusters.setUp()
TestClusters.setUpClass()
TestClusters.setUpPaths()
TestClusters.shortDescription()
TestClusters.skipTest()
TestClusters.subTest()
TestClusters.tearDown()
TestClusters.tearDownClass()
TestClusters.testClusterAdd
TestClusters.testClusterAdd_0_Random()
TestClusters.testClusterAdd_1_FPSimilarityMaxMin()
TestClusters.testClusterAdd_2_FPSimilarityLeaderPicker()
TestClusters.testClusterAdd_3_Scaffold()
TestClusters.validate_split()
TestScaffolds
TestScaffolds.addClassCleanup()
TestScaffolds.addCleanup()
TestScaffolds.addTypeEqualityFunc()
TestScaffolds.assertAlmostEqual()
TestScaffolds.assertCountEqual()
TestScaffolds.assertDictEqual()
TestScaffolds.assertEqual()
TestScaffolds.assertFalse()
TestScaffolds.assertGreater()
TestScaffolds.assertGreaterEqual()
TestScaffolds.assertIn()
TestScaffolds.assertIs()
TestScaffolds.assertIsInstance()
TestScaffolds.assertIsNone()
TestScaffolds.assertIsNot()
TestScaffolds.assertIsNotNone()
TestScaffolds.assertLess()
TestScaffolds.assertLessEqual()
TestScaffolds.assertListEqual()
TestScaffolds.assertLogs()
TestScaffolds.assertMultiLineEqual()
TestScaffolds.assertNoLogs()
TestScaffolds.assertNotAlmostEqual()
TestScaffolds.assertNotEqual()
TestScaffolds.assertNotIn()
TestScaffolds.assertNotIsInstance()
TestScaffolds.assertNotRegex()
TestScaffolds.assertRaises()
TestScaffolds.assertRaisesRegex()
TestScaffolds.assertRegex()
TestScaffolds.assertSequenceEqual()
TestScaffolds.assertSetEqual()
TestScaffolds.assertTrue()
TestScaffolds.assertTupleEqual()
TestScaffolds.assertWarns()
TestScaffolds.assertWarnsRegex()
TestScaffolds.clearGenerated()
TestScaffolds.countTestCases()
TestScaffolds.createLargeMultitaskDataSet()
TestScaffolds.createLargeTestDataSet()
TestScaffolds.createSmallTestDataSet()
TestScaffolds.createTestDataSetFromFrame()
TestScaffolds.debug()
TestScaffolds.defaultTestResult()
TestScaffolds.doClassCleanups()
TestScaffolds.doCleanups()
TestScaffolds.enterClassContext()
TestScaffolds.enterContext()
TestScaffolds.fail()
TestScaffolds.failureException
TestScaffolds.getAllDescriptors()
TestScaffolds.getBigDF()
TestScaffolds.getDataPrepGrid()
TestScaffolds.getDefaultCalculatorCombo()
TestScaffolds.getDefaultPrep()
TestScaffolds.getPrepCombos()
TestScaffolds.getSmallDF()
TestScaffolds.id()
TestScaffolds.longMessage
TestScaffolds.maxDiff
TestScaffolds.run()
TestScaffolds.setUp()
TestScaffolds.setUpClass()
TestScaffolds.setUpPaths()
TestScaffolds.shortDescription()
TestScaffolds.skipTest()
TestScaffolds.subTest()
TestScaffolds.tearDown()
TestScaffolds.tearDownClass()
TestScaffolds.testScaffoldAdd
TestScaffolds.testScaffoldAdd_0_Murcko()
TestScaffolds.testScaffoldAdd_1_BemisMurcko()
TestScaffolds.testScaffoldAdd_2_BemisMurckoCSK()
TestScaffolds.testScaffoldAdd_3_BemisMurckoJustCSK()
TestScaffolds.testScaffoldAdd_4_BemisMurckoOff()
TestScaffolds.validate_split()
TestStandardizers
TestStandardizers.addClassCleanup()
TestStandardizers.addCleanup()
TestStandardizers.addTypeEqualityFunc()
TestStandardizers.assertAlmostEqual()
TestStandardizers.assertCountEqual()
TestStandardizers.assertDictEqual()
TestStandardizers.assertEqual()
TestStandardizers.assertFalse()
TestStandardizers.assertGreater()
TestStandardizers.assertGreaterEqual()
TestStandardizers.assertIn()
TestStandardizers.assertIs()
TestStandardizers.assertIsInstance()
TestStandardizers.assertIsNone()
TestStandardizers.assertIsNot()
TestStandardizers.assertIsNotNone()
TestStandardizers.assertLess()
TestStandardizers.assertLessEqual()
TestStandardizers.assertListEqual()
TestStandardizers.assertLogs()
TestStandardizers.assertMultiLineEqual()
TestStandardizers.assertNoLogs()
TestStandardizers.assertNotAlmostEqual()
TestStandardizers.assertNotEqual()
TestStandardizers.assertNotIn()
TestStandardizers.assertNotIsInstance()
TestStandardizers.assertNotRegex()
TestStandardizers.assertRaises()
TestStandardizers.assertRaisesRegex()
TestStandardizers.assertRegex()
TestStandardizers.assertSequenceEqual()
TestStandardizers.assertSetEqual()
TestStandardizers.assertTrue()
TestStandardizers.assertTupleEqual()
TestStandardizers.assertWarns()
TestStandardizers.assertWarnsRegex()
TestStandardizers.clearGenerated()
TestStandardizers.countTestCases()
TestStandardizers.createLargeMultitaskDataSet()
TestStandardizers.createLargeTestDataSet()
TestStandardizers.createSmallTestDataSet()
TestStandardizers.createTestDataSetFromFrame()
TestStandardizers.debug()
TestStandardizers.defaultTestResult()
TestStandardizers.doClassCleanups()
TestStandardizers.doCleanups()
TestStandardizers.enterClassContext()
TestStandardizers.enterContext()
TestStandardizers.fail()
TestStandardizers.failureException
TestStandardizers.getAllDescriptors()
TestStandardizers.getBigDF()
TestStandardizers.getDataPrepGrid()
TestStandardizers.getDefaultCalculatorCombo()
TestStandardizers.getDefaultPrep()
TestStandardizers.getPrepCombos()
TestStandardizers.getSmallDF()
TestStandardizers.id()
TestStandardizers.longMessage
TestStandardizers.maxDiff
TestStandardizers.run()
TestStandardizers.setUp()
TestStandardizers.setUpClass()
TestStandardizers.setUpPaths()
TestStandardizers.shortDescription()
TestStandardizers.skipTest()
TestStandardizers.subTest()
TestStandardizers.tearDown()
TestStandardizers.tearDownClass()
TestStandardizers.testInvalidFilter()
TestStandardizers.validate_split()
- Module contents
- qsprpred.data.descriptors package
- Submodules
- qsprpred.data.descriptors.fingerprints module
AtomPairFP
AtomPairFP.descriptors
AtomPairFP.dtype
AtomPairFP.fromFile()
AtomPairFP.fromJSON()
AtomPairFP.getDescriptors()
AtomPairFP.isFP
AtomPairFP.iterMols()
AtomPairFP.prepMols()
AtomPairFP.requiredProps
AtomPairFP.supportsParallel
AtomPairFP.toFile()
AtomPairFP.toJSON()
AtomPairFP.transformToFeatureNames()
AtomPairFP.treatInfs()
AtomPairFP.usedBits
AvalonFP
AvalonFP.descriptors
AvalonFP.dtype
AvalonFP.fromFile()
AvalonFP.fromJSON()
AvalonFP.getDescriptors()
AvalonFP.isFP
AvalonFP.iterMols()
AvalonFP.prepMols()
AvalonFP.requiredProps
AvalonFP.supportsParallel
AvalonFP.toFile()
AvalonFP.toJSON()
AvalonFP.transformToFeatureNames()
AvalonFP.treatInfs()
AvalonFP.usedBits
Fingerprint
Fingerprint.descriptors
Fingerprint.dtype
Fingerprint.fromFile()
Fingerprint.fromJSON()
Fingerprint.getDescriptors()
Fingerprint.isFP
Fingerprint.iterMols()
Fingerprint.prepMols()
Fingerprint.requiredProps
Fingerprint.supportsParallel
Fingerprint.toFile()
Fingerprint.toJSON()
Fingerprint.transformToFeatureNames()
Fingerprint.treatInfs()
Fingerprint.usedBits
LayeredFP
LayeredFP.descriptors
LayeredFP.dtype
LayeredFP.fromFile()
LayeredFP.fromJSON()
LayeredFP.getDescriptors()
LayeredFP.isFP
LayeredFP.iterMols()
LayeredFP.prepMols()
LayeredFP.requiredProps
LayeredFP.supportsParallel
LayeredFP.toFile()
LayeredFP.toJSON()
LayeredFP.transformToFeatureNames()
LayeredFP.treatInfs()
LayeredFP.usedBits
MaccsFP
MorganFP
MorganFP.descriptors
MorganFP.dtype
MorganFP.fromFile()
MorganFP.fromJSON()
MorganFP.getDescriptors()
MorganFP.isFP
MorganFP.iterMols()
MorganFP.prepMols()
MorganFP.requiredProps
MorganFP.supportsParallel
MorganFP.toFile()
MorganFP.toJSON()
MorganFP.transformToFeatureNames()
MorganFP.treatInfs()
MorganFP.usedBits
PatternFP
PatternFP.descriptors
PatternFP.dtype
PatternFP.fromFile()
PatternFP.fromJSON()
PatternFP.getDescriptors()
PatternFP.isFP
PatternFP.iterMols()
PatternFP.prepMols()
PatternFP.requiredProps
PatternFP.supportsParallel
PatternFP.toFile()
PatternFP.toJSON()
PatternFP.transformToFeatureNames()
PatternFP.treatInfs()
PatternFP.usedBits
RDKitFP
RDKitMACCSFP
RDKitMACCSFP.descriptors
RDKitMACCSFP.dtype
RDKitMACCSFP.fromFile()
RDKitMACCSFP.fromJSON()
RDKitMACCSFP.getDescriptors()
RDKitMACCSFP.isFP
RDKitMACCSFP.iterMols()
RDKitMACCSFP.prepMols()
RDKitMACCSFP.requiredProps
RDKitMACCSFP.supportsParallel
RDKitMACCSFP.toFile()
RDKitMACCSFP.toJSON()
RDKitMACCSFP.transformToFeatureNames()
RDKitMACCSFP.treatInfs()
RDKitMACCSFP.usedBits
TopologicalFP
TopologicalFP.descriptors
TopologicalFP.dtype
TopologicalFP.fromFile()
TopologicalFP.fromJSON()
TopologicalFP.getDescriptors()
TopologicalFP.isFP
TopologicalFP.iterMols()
TopologicalFP.prepMols()
TopologicalFP.requiredProps
TopologicalFP.supportsParallel
TopologicalFP.toFile()
TopologicalFP.toJSON()
TopologicalFP.transformToFeatureNames()
TopologicalFP.treatInfs()
TopologicalFP.usedBits
- qsprpred.data.descriptors.sets module
DataFrameDescriptorSet
DataFrameDescriptorSet.descriptors
DataFrameDescriptorSet.dtype
DataFrameDescriptorSet.fromFile()
DataFrameDescriptorSet.fromJSON()
DataFrameDescriptorSet.getDF()
DataFrameDescriptorSet.getDescriptors()
DataFrameDescriptorSet.getIndex()
DataFrameDescriptorSet.getIndexCols()
DataFrameDescriptorSet.isFP
DataFrameDescriptorSet.iterMols()
DataFrameDescriptorSet.prepMols()
DataFrameDescriptorSet.requiredProps
DataFrameDescriptorSet.setIndex()
DataFrameDescriptorSet.supportsParallel
DataFrameDescriptorSet.toFile()
DataFrameDescriptorSet.toJSON()
DataFrameDescriptorSet.transformToFeatureNames()
DataFrameDescriptorSet.treatInfs()
DescriptorSet
DescriptorSet.descriptors
DescriptorSet.dtype
DescriptorSet.fromFile()
DescriptorSet.fromJSON()
DescriptorSet.getDescriptors()
DescriptorSet.isFP
DescriptorSet.iterMols()
DescriptorSet.prepMols()
DescriptorSet.requiredProps
DescriptorSet.supportsParallel
DescriptorSet.toFile()
DescriptorSet.toJSON()
DescriptorSet.transformToFeatureNames()
DescriptorSet.treatInfs()
DrugExPhyschem
DrugExPhyschem.descriptors
DrugExPhyschem.dtype
DrugExPhyschem.fromFile()
DrugExPhyschem.fromJSON()
DrugExPhyschem.getDescriptors()
DrugExPhyschem.getPropDict()
DrugExPhyschem.isFP
DrugExPhyschem.iterMols()
DrugExPhyschem.prepMols()
DrugExPhyschem.requiredProps
DrugExPhyschem.supportsParallel
DrugExPhyschem.toFile()
DrugExPhyschem.toJSON()
DrugExPhyschem.transformToFeatureNames()
DrugExPhyschem.treatInfs()
PredictorDesc
PredictorDesc.descriptors
PredictorDesc.dtype
PredictorDesc.fromFile()
PredictorDesc.fromJSON()
PredictorDesc.getDescriptors()
PredictorDesc.isFP
PredictorDesc.iterMols()
PredictorDesc.prepMols()
PredictorDesc.requiredProps
PredictorDesc.supportsParallel
PredictorDesc.toFile()
PredictorDesc.toJSON()
PredictorDesc.transformToFeatureNames()
PredictorDesc.treatInfs()
RDKitDescs
RDKitDescs.descriptors
RDKitDescs.dtype
RDKitDescs.fromFile()
RDKitDescs.fromJSON()
RDKitDescs.getDescriptors()
RDKitDescs.isFP
RDKitDescs.iterMols()
RDKitDescs.prepMols()
RDKitDescs.requiredProps
RDKitDescs.supportsParallel
RDKitDescs.toFile()
RDKitDescs.toJSON()
RDKitDescs.transformToFeatureNames()
RDKitDescs.treatInfs()
SmilesDesc
SmilesDesc.descriptors
SmilesDesc.dtype
SmilesDesc.fromFile()
SmilesDesc.fromJSON()
SmilesDesc.getDescriptors()
SmilesDesc.isFP
SmilesDesc.iterMols()
SmilesDesc.prepMols()
SmilesDesc.requiredProps
SmilesDesc.supportsParallel
SmilesDesc.toFile()
SmilesDesc.toJSON()
SmilesDesc.transformToFeatureNames()
SmilesDesc.treatInfs()
TanimotoDistances
TanimotoDistances.calculate_fingerprints()
TanimotoDistances.descriptors
TanimotoDistances.dtype
TanimotoDistances.fromFile()
TanimotoDistances.fromJSON()
TanimotoDistances.getDescriptors()
TanimotoDistances.isFP
TanimotoDistances.iterMols()
TanimotoDistances.prepMols()
TanimotoDistances.requiredProps
TanimotoDistances.supportsParallel
TanimotoDistances.toFile()
TanimotoDistances.toJSON()
TanimotoDistances.transformToFeatureNames()
TanimotoDistances.treatInfs()
- qsprpred.data.descriptors.tests module
TestDescriptorCalculation
TestDescriptorCalculation.addClassCleanup()
TestDescriptorCalculation.addCleanup()
TestDescriptorCalculation.addTypeEqualityFunc()
TestDescriptorCalculation.assertAlmostEqual()
TestDescriptorCalculation.assertCountEqual()
TestDescriptorCalculation.assertDictEqual()
TestDescriptorCalculation.assertEqual()
TestDescriptorCalculation.assertFalse()
TestDescriptorCalculation.assertGreater()
TestDescriptorCalculation.assertGreaterEqual()
TestDescriptorCalculation.assertIn()
TestDescriptorCalculation.assertIs()
TestDescriptorCalculation.assertIsInstance()
TestDescriptorCalculation.assertIsNone()
TestDescriptorCalculation.assertIsNot()
TestDescriptorCalculation.assertIsNotNone()
TestDescriptorCalculation.assertLess()
TestDescriptorCalculation.assertLessEqual()
TestDescriptorCalculation.assertListEqual()
TestDescriptorCalculation.assertLogs()
TestDescriptorCalculation.assertMultiLineEqual()
TestDescriptorCalculation.assertNoLogs()
TestDescriptorCalculation.assertNotAlmostEqual()
TestDescriptorCalculation.assertNotEqual()
TestDescriptorCalculation.assertNotIn()
TestDescriptorCalculation.assertNotIsInstance()
TestDescriptorCalculation.assertNotRegex()
TestDescriptorCalculation.assertRaises()
TestDescriptorCalculation.assertRaisesRegex()
TestDescriptorCalculation.assertRegex()
TestDescriptorCalculation.assertSequenceEqual()
TestDescriptorCalculation.assertSetEqual()
TestDescriptorCalculation.assertTrue()
TestDescriptorCalculation.assertTupleEqual()
TestDescriptorCalculation.assertWarns()
TestDescriptorCalculation.assertWarnsRegex()
TestDescriptorCalculation.clearGenerated()
TestDescriptorCalculation.countTestCases()
TestDescriptorCalculation.createLargeMultitaskDataSet()
TestDescriptorCalculation.createLargeTestDataSet()
TestDescriptorCalculation.createSmallTestDataSet()
TestDescriptorCalculation.createTestDataSetFromFrame()
TestDescriptorCalculation.debug()
TestDescriptorCalculation.defaultTestResult()
TestDescriptorCalculation.doClassCleanups()
TestDescriptorCalculation.doCleanups()
TestDescriptorCalculation.enterClassContext()
TestDescriptorCalculation.enterContext()
TestDescriptorCalculation.fail()
TestDescriptorCalculation.failureException
TestDescriptorCalculation.getAllDescriptors()
TestDescriptorCalculation.getBigDF()
TestDescriptorCalculation.getDataPrepGrid()
TestDescriptorCalculation.getDefaultCalculatorCombo()
TestDescriptorCalculation.getDefaultPrep()
TestDescriptorCalculation.getDescList()
TestDescriptorCalculation.getPrepCombos()
TestDescriptorCalculation.getSmallDF()
TestDescriptorCalculation.id()
TestDescriptorCalculation.longMessage
TestDescriptorCalculation.maxDiff
TestDescriptorCalculation.run()
TestDescriptorCalculation.setUp()
TestDescriptorCalculation.setUpClass()
TestDescriptorCalculation.setUpPaths()
TestDescriptorCalculation.shortDescription()
TestDescriptorCalculation.skipTest()
TestDescriptorCalculation.subTest()
TestDescriptorCalculation.tearDown()
TestDescriptorCalculation.tearDownClass()
TestDescriptorCalculation.testDropping()
TestDescriptorCalculation.testSwitching
TestDescriptorCalculation.testSwitching_0()
TestDescriptorCalculation.testSwitching_1()
TestDescriptorCalculation.testSwitching_2()
TestDescriptorCalculation.testSwitching_3()
TestDescriptorCalculation.validate_split()
TestDescriptorSets
TestDescriptorSets.addClassCleanup()
TestDescriptorSets.addCleanup()
TestDescriptorSets.addTypeEqualityFunc()
TestDescriptorSets.assertAlmostEqual()
TestDescriptorSets.assertCountEqual()
TestDescriptorSets.assertDictEqual()
TestDescriptorSets.assertEqual()
TestDescriptorSets.assertFalse()
TestDescriptorSets.assertGreater()
TestDescriptorSets.assertGreaterEqual()
TestDescriptorSets.assertIn()
TestDescriptorSets.assertIs()
TestDescriptorSets.assertIsInstance()
TestDescriptorSets.assertIsNone()
TestDescriptorSets.assertIsNot()
TestDescriptorSets.assertIsNotNone()
TestDescriptorSets.assertLess()
TestDescriptorSets.assertLessEqual()
TestDescriptorSets.assertListEqual()
TestDescriptorSets.assertLogs()
TestDescriptorSets.assertMultiLineEqual()
TestDescriptorSets.assertNoLogs()
TestDescriptorSets.assertNotAlmostEqual()
TestDescriptorSets.assertNotEqual()
TestDescriptorSets.assertNotIn()
TestDescriptorSets.assertNotIsInstance()
TestDescriptorSets.assertNotRegex()
TestDescriptorSets.assertRaises()
TestDescriptorSets.assertRaisesRegex()
TestDescriptorSets.assertRegex()
TestDescriptorSets.assertSequenceEqual()
TestDescriptorSets.assertSetEqual()
TestDescriptorSets.assertTrue()
TestDescriptorSets.assertTupleEqual()
TestDescriptorSets.assertWarns()
TestDescriptorSets.assertWarnsRegex()
TestDescriptorSets.clearGenerated()
TestDescriptorSets.countTestCases()
TestDescriptorSets.createLargeMultitaskDataSet()
TestDescriptorSets.createLargeTestDataSet()
TestDescriptorSets.createSmallTestDataSet()
TestDescriptorSets.createTestDataSetFromFrame()
TestDescriptorSets.debug()
TestDescriptorSets.defaultTestResult()
TestDescriptorSets.doClassCleanups()
TestDescriptorSets.doCleanups()
TestDescriptorSets.enterClassContext()
TestDescriptorSets.enterContext()
TestDescriptorSets.fail()
TestDescriptorSets.failureException
TestDescriptorSets.getAllDescriptors()
TestDescriptorSets.getBigDF()
TestDescriptorSets.getDataPrepGrid()
TestDescriptorSets.getDefaultCalculatorCombo()
TestDescriptorSets.getDefaultPrep()
TestDescriptorSets.getPrepCombos()
TestDescriptorSets.getSmallDF()
TestDescriptorSets.id()
TestDescriptorSets.longMessage
TestDescriptorSets.maxDiff
TestDescriptorSets.run()
TestDescriptorSets.setUp()
TestDescriptorSets.setUpClass()
TestDescriptorSets.setUpPaths()
TestDescriptorSets.shortDescription()
TestDescriptorSets.skipTest()
TestDescriptorSets.subTest()
TestDescriptorSets.tearDown()
TestDescriptorSets.tearDownClass()
TestDescriptorSets.testConsistency()
TestDescriptorSets.testDrugExPhyschem()
TestDescriptorSets.testFingerprintSet()
TestDescriptorSets.testPredictorDescriptor()
TestDescriptorSets.testRDKitDescs()
TestDescriptorSets.testSmilesDesc()
TestDescriptorSets.testTanimotoDistances()
TestDescriptorSets.validate_split()
TestDescriptorsAll
TestDescriptorsAll.addClassCleanup()
TestDescriptorsAll.addCleanup()
TestDescriptorsAll.addTypeEqualityFunc()
TestDescriptorsAll.assertAlmostEqual()
TestDescriptorsAll.assertCountEqual()
TestDescriptorsAll.assertDictEqual()
TestDescriptorsAll.assertEqual()
TestDescriptorsAll.assertFalse()
TestDescriptorsAll.assertGreater()
TestDescriptorsAll.assertGreaterEqual()
TestDescriptorsAll.assertIn()
TestDescriptorsAll.assertIs()
TestDescriptorsAll.assertIsInstance()
TestDescriptorsAll.assertIsNone()
TestDescriptorsAll.assertIsNot()
TestDescriptorsAll.assertIsNotNone()
TestDescriptorsAll.assertLess()
TestDescriptorsAll.assertLessEqual()
TestDescriptorsAll.assertListEqual()
TestDescriptorsAll.assertLogs()
TestDescriptorsAll.assertMultiLineEqual()
TestDescriptorsAll.assertNoLogs()
TestDescriptorsAll.assertNotAlmostEqual()
TestDescriptorsAll.assertNotEqual()
TestDescriptorsAll.assertNotIn()
TestDescriptorsAll.assertNotIsInstance()
TestDescriptorsAll.assertNotRegex()
TestDescriptorsAll.assertRaises()
TestDescriptorsAll.assertRaisesRegex()
TestDescriptorsAll.assertRegex()
TestDescriptorsAll.assertSequenceEqual()
TestDescriptorsAll.assertSetEqual()
TestDescriptorsAll.assertTrue()
TestDescriptorsAll.assertTupleEqual()
TestDescriptorsAll.assertWarns()
TestDescriptorsAll.assertWarnsRegex()
TestDescriptorsAll.checkDataSetContainsDescriptorSet()
TestDescriptorsAll.checkDescriptors()
TestDescriptorsAll.checkFeatures()
TestDescriptorsAll.clearGenerated()
TestDescriptorsAll.countTestCases()
TestDescriptorsAll.createLargeMultitaskDataSet()
TestDescriptorsAll.createLargeTestDataSet()
TestDescriptorsAll.createSmallTestDataSet()
TestDescriptorsAll.createTestDataSetFromFrame()
TestDescriptorsAll.debug()
TestDescriptorsAll.defaultTestResult()
TestDescriptorsAll.doClassCleanups()
TestDescriptorsAll.doCleanups()
TestDescriptorsAll.enterClassContext()
TestDescriptorsAll.enterContext()
TestDescriptorsAll.fail()
TestDescriptorsAll.failureException
TestDescriptorsAll.getAllDescriptors()
TestDescriptorsAll.getBigDF()
TestDescriptorsAll.getDatSetName()
TestDescriptorsAll.getDataPrepGrid()
TestDescriptorsAll.getDefaultCalculatorCombo()
TestDescriptorsAll.getDefaultPrep()
TestDescriptorsAll.getPrepCombos()
TestDescriptorsAll.getSmallDF()
TestDescriptorsAll.id()
TestDescriptorsAll.longMessage
TestDescriptorsAll.maxDiff
TestDescriptorsAll.run()
TestDescriptorsAll.setUp()
TestDescriptorsAll.setUpClass()
TestDescriptorsAll.setUpPaths()
TestDescriptorsAll.shortDescription()
TestDescriptorsAll.skipTest()
TestDescriptorsAll.subTest()
TestDescriptorsAll.tearDown()
TestDescriptorsAll.tearDownClass()
TestDescriptorsAll.testDescriptorsAll
TestDescriptorsAll.testDescriptorsAll_00_RDkit_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_01_DrugExPhyschem_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_02_PredictorDesc_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_03_TanimotoDistances_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_04_AtomPairFP_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_05_AvalonFP_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_06_LayeredFP_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_07_MACCSFP_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_08_MorganFP_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_09_PatternFP_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_10_RDKitFP_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_11_RDKitMACCSFP_REGRESSION()
TestDescriptorsAll.testDescriptorsAll_12_TopologicalFP_REGRESSION()
TestDescriptorsAll.validate_split()
- Module contents
- qsprpred.data.processing package
- Submodules
- qsprpred.data.processing.applicability_domain module
- qsprpred.data.processing.data_filters module
- qsprpred.data.processing.feature_filters module
- qsprpred.data.processing.feature_standardizers module
- qsprpred.data.processing.mol_processor module
- qsprpred.data.processing.tests module
TestDataFilters
TestDataFilters.addClassCleanup()
TestDataFilters.addCleanup()
TestDataFilters.addTypeEqualityFunc()
TestDataFilters.assertAlmostEqual()
TestDataFilters.assertCountEqual()
TestDataFilters.assertDictEqual()
TestDataFilters.assertEqual()
TestDataFilters.assertFalse()
TestDataFilters.assertGreater()
TestDataFilters.assertGreaterEqual()
TestDataFilters.assertIn()
TestDataFilters.assertIs()
TestDataFilters.assertIsInstance()
TestDataFilters.assertIsNone()
TestDataFilters.assertIsNot()
TestDataFilters.assertIsNotNone()
TestDataFilters.assertLess()
TestDataFilters.assertLessEqual()
TestDataFilters.assertListEqual()
TestDataFilters.assertLogs()
TestDataFilters.assertMultiLineEqual()
TestDataFilters.assertNoLogs()
TestDataFilters.assertNotAlmostEqual()
TestDataFilters.assertNotEqual()
TestDataFilters.assertNotIn()
TestDataFilters.assertNotIsInstance()
TestDataFilters.assertNotRegex()
TestDataFilters.assertRaises()
TestDataFilters.assertRaisesRegex()
TestDataFilters.assertRegex()
TestDataFilters.assertSequenceEqual()
TestDataFilters.assertSetEqual()
TestDataFilters.assertTrue()
TestDataFilters.assertTupleEqual()
TestDataFilters.assertWarns()
TestDataFilters.assertWarnsRegex()
TestDataFilters.clearGenerated()
TestDataFilters.countTestCases()
TestDataFilters.createLargeMultitaskDataSet()
TestDataFilters.createLargeTestDataSet()
TestDataFilters.createSmallTestDataSet()
TestDataFilters.createTestDataSetFromFrame()
TestDataFilters.debug()
TestDataFilters.defaultTestResult()
TestDataFilters.doClassCleanups()
TestDataFilters.doCleanups()
TestDataFilters.enterClassContext()
TestDataFilters.enterContext()
TestDataFilters.fail()
TestDataFilters.failureException
TestDataFilters.getAllDescriptors()
TestDataFilters.getBigDF()
TestDataFilters.getDataPrepGrid()
TestDataFilters.getDefaultCalculatorCombo()
TestDataFilters.getDefaultPrep()
TestDataFilters.getPrepCombos()
TestDataFilters.getSmallDF()
TestDataFilters.id()
TestDataFilters.longMessage
TestDataFilters.maxDiff
TestDataFilters.run()
TestDataFilters.setUp()
TestDataFilters.setUpClass()
TestDataFilters.setUpPaths()
TestDataFilters.shortDescription()
TestDataFilters.skipTest()
TestDataFilters.subTest()
TestDataFilters.tearDown()
TestDataFilters.tearDownClass()
TestDataFilters.testCategoryFilter()
TestDataFilters.testConsistency()
TestDataFilters.testRepeatsFilter()
TestDataFilters.validate_split()
TestFeatureFilters
TestFeatureFilters.addClassCleanup()
TestFeatureFilters.addCleanup()
TestFeatureFilters.addTypeEqualityFunc()
TestFeatureFilters.assertAlmostEqual()
TestFeatureFilters.assertCountEqual()
TestFeatureFilters.assertDictEqual()
TestFeatureFilters.assertEqual()
TestFeatureFilters.assertFalse()
TestFeatureFilters.assertGreater()
TestFeatureFilters.assertGreaterEqual()
TestFeatureFilters.assertIn()
TestFeatureFilters.assertIs()
TestFeatureFilters.assertIsInstance()
TestFeatureFilters.assertIsNone()
TestFeatureFilters.assertIsNot()
TestFeatureFilters.assertIsNotNone()
TestFeatureFilters.assertLess()
TestFeatureFilters.assertLessEqual()
TestFeatureFilters.assertListEqual()
TestFeatureFilters.assertLogs()
TestFeatureFilters.assertMultiLineEqual()
TestFeatureFilters.assertNoLogs()
TestFeatureFilters.assertNotAlmostEqual()
TestFeatureFilters.assertNotEqual()
TestFeatureFilters.assertNotIn()
TestFeatureFilters.assertNotIsInstance()
TestFeatureFilters.assertNotRegex()
TestFeatureFilters.assertRaises()
TestFeatureFilters.assertRaisesRegex()
TestFeatureFilters.assertRegex()
TestFeatureFilters.assertSequenceEqual()
TestFeatureFilters.assertSetEqual()
TestFeatureFilters.assertTrue()
TestFeatureFilters.assertTupleEqual()
TestFeatureFilters.assertWarns()
TestFeatureFilters.assertWarnsRegex()
TestFeatureFilters.clearGenerated()
TestFeatureFilters.countTestCases()
TestFeatureFilters.debug()
TestFeatureFilters.defaultTestResult()
TestFeatureFilters.doClassCleanups()
TestFeatureFilters.doCleanups()
TestFeatureFilters.enterClassContext()
TestFeatureFilters.enterContext()
TestFeatureFilters.fail()
TestFeatureFilters.failureException
TestFeatureFilters.id()
TestFeatureFilters.longMessage
TestFeatureFilters.maxDiff
TestFeatureFilters.recalculateWithMultiIndex()
TestFeatureFilters.run()
TestFeatureFilters.setUp()
TestFeatureFilters.setUpClass()
TestFeatureFilters.setUpPaths()
TestFeatureFilters.shortDescription()
TestFeatureFilters.skipTest()
TestFeatureFilters.subTest()
TestFeatureFilters.tearDown()
TestFeatureFilters.tearDownClass()
TestFeatureFilters.testBorutaFilter
TestFeatureFilters.testBorutaFilter_0()
TestFeatureFilters.testBorutaFilter_1()
TestFeatureFilters.testDefaultDescriptorAdd()
TestFeatureFilters.testHighCorrelationFilter
TestFeatureFilters.testHighCorrelationFilter_0()
TestFeatureFilters.testHighCorrelationFilter_1()
TestFeatureFilters.testLowVarianceFilter
TestFeatureFilters.testLowVarianceFilter_0()
TestFeatureFilters.testLowVarianceFilter_1()
TestFeatureStandardizer
TestFeatureStandardizer.addClassCleanup()
TestFeatureStandardizer.addCleanup()
TestFeatureStandardizer.addTypeEqualityFunc()
TestFeatureStandardizer.assertAlmostEqual()
TestFeatureStandardizer.assertCountEqual()
TestFeatureStandardizer.assertDictEqual()
TestFeatureStandardizer.assertEqual()
TestFeatureStandardizer.assertFalse()
TestFeatureStandardizer.assertGreater()
TestFeatureStandardizer.assertGreaterEqual()
TestFeatureStandardizer.assertIn()
TestFeatureStandardizer.assertIs()
TestFeatureStandardizer.assertIsInstance()
TestFeatureStandardizer.assertIsNone()
TestFeatureStandardizer.assertIsNot()
TestFeatureStandardizer.assertIsNotNone()
TestFeatureStandardizer.assertLess()
TestFeatureStandardizer.assertLessEqual()
TestFeatureStandardizer.assertListEqual()
TestFeatureStandardizer.assertLogs()
TestFeatureStandardizer.assertMultiLineEqual()
TestFeatureStandardizer.assertNoLogs()
TestFeatureStandardizer.assertNotAlmostEqual()
TestFeatureStandardizer.assertNotEqual()
TestFeatureStandardizer.assertNotIn()
TestFeatureStandardizer.assertNotIsInstance()
TestFeatureStandardizer.assertNotRegex()
TestFeatureStandardizer.assertRaises()
TestFeatureStandardizer.assertRaisesRegex()
TestFeatureStandardizer.assertRegex()
TestFeatureStandardizer.assertSequenceEqual()
TestFeatureStandardizer.assertSetEqual()
TestFeatureStandardizer.assertTrue()
TestFeatureStandardizer.assertTupleEqual()
TestFeatureStandardizer.assertWarns()
TestFeatureStandardizer.assertWarnsRegex()
TestFeatureStandardizer.clearGenerated()
TestFeatureStandardizer.countTestCases()
TestFeatureStandardizer.createLargeMultitaskDataSet()
TestFeatureStandardizer.createLargeTestDataSet()
TestFeatureStandardizer.createSmallTestDataSet()
TestFeatureStandardizer.createTestDataSetFromFrame()
TestFeatureStandardizer.debug()
TestFeatureStandardizer.defaultTestResult()
TestFeatureStandardizer.doClassCleanups()
TestFeatureStandardizer.doCleanups()
TestFeatureStandardizer.enterClassContext()
TestFeatureStandardizer.enterContext()
TestFeatureStandardizer.fail()
TestFeatureStandardizer.failureException
TestFeatureStandardizer.getAllDescriptors()
TestFeatureStandardizer.getBigDF()
TestFeatureStandardizer.getDataPrepGrid()
TestFeatureStandardizer.getDefaultCalculatorCombo()
TestFeatureStandardizer.getDefaultPrep()
TestFeatureStandardizer.getPrepCombos()
TestFeatureStandardizer.getSmallDF()
TestFeatureStandardizer.id()
TestFeatureStandardizer.longMessage
TestFeatureStandardizer.maxDiff
TestFeatureStandardizer.run()
TestFeatureStandardizer.setUp()
TestFeatureStandardizer.setUpClass()
TestFeatureStandardizer.setUpPaths()
TestFeatureStandardizer.shortDescription()
TestFeatureStandardizer.skipTest()
TestFeatureStandardizer.subTest()
TestFeatureStandardizer.tearDown()
TestFeatureStandardizer.tearDownClass()
TestFeatureStandardizer.testFeaturesStandardizer()
TestFeatureStandardizer.validate_split()
TestMolProcessor
TestMolProcessor.TestingProcessor
TestMolProcessor.addClassCleanup()
TestMolProcessor.addCleanup()
TestMolProcessor.addTypeEqualityFunc()
TestMolProcessor.assertAlmostEqual()
TestMolProcessor.assertCountEqual()
TestMolProcessor.assertDictEqual()
TestMolProcessor.assertEqual()
TestMolProcessor.assertFalse()
TestMolProcessor.assertGreater()
TestMolProcessor.assertGreaterEqual()
TestMolProcessor.assertIn()
TestMolProcessor.assertIs()
TestMolProcessor.assertIsInstance()
TestMolProcessor.assertIsNone()
TestMolProcessor.assertIsNot()
TestMolProcessor.assertIsNotNone()
TestMolProcessor.assertLess()
TestMolProcessor.assertLessEqual()
TestMolProcessor.assertListEqual()
TestMolProcessor.assertLogs()
TestMolProcessor.assertMultiLineEqual()
TestMolProcessor.assertNoLogs()
TestMolProcessor.assertNotAlmostEqual()
TestMolProcessor.assertNotEqual()
TestMolProcessor.assertNotIn()
TestMolProcessor.assertNotIsInstance()
TestMolProcessor.assertNotRegex()
TestMolProcessor.assertRaises()
TestMolProcessor.assertRaisesRegex()
TestMolProcessor.assertRegex()
TestMolProcessor.assertSequenceEqual()
TestMolProcessor.assertSetEqual()
TestMolProcessor.assertTrue()
TestMolProcessor.assertTupleEqual()
TestMolProcessor.assertWarns()
TestMolProcessor.assertWarnsRegex()
TestMolProcessor.clearGenerated()
TestMolProcessor.countTestCases()
TestMolProcessor.createLargeMultitaskDataSet()
TestMolProcessor.createLargeTestDataSet()
TestMolProcessor.createSmallTestDataSet()
TestMolProcessor.createTestDataSetFromFrame()
TestMolProcessor.debug()
TestMolProcessor.defaultTestResult()
TestMolProcessor.doClassCleanups()
TestMolProcessor.doCleanups()
TestMolProcessor.enterClassContext()
TestMolProcessor.enterContext()
TestMolProcessor.fail()
TestMolProcessor.failureException
TestMolProcessor.getAllDescriptors()
TestMolProcessor.getBigDF()
TestMolProcessor.getDataPrepGrid()
TestMolProcessor.getDefaultCalculatorCombo()
TestMolProcessor.getDefaultPrep()
TestMolProcessor.getPrepCombos()
TestMolProcessor.getSmallDF()
TestMolProcessor.id()
TestMolProcessor.longMessage
TestMolProcessor.maxDiff
TestMolProcessor.run()
TestMolProcessor.setUp()
TestMolProcessor.setUpClass()
TestMolProcessor.setUpPaths()
TestMolProcessor.shortDescription()
TestMolProcessor.skipTest()
TestMolProcessor.subTest()
TestMolProcessor.tearDown()
TestMolProcessor.tearDownClass()
TestMolProcessor.testMolProcess
TestMolProcessor.testMolProcess_00_1_50_None_True_None_None()
TestMolProcessor.testMolProcess_01_1_50_None_True_None__a_1_()
TestMolProcessor.testMolProcess_02_1_50_None_True__1_2__None()
TestMolProcessor.testMolProcess_03_1_50_None_True__1_2___a_1_()
TestMolProcessor.testMolProcess_04_1_50_None_False_None_None()
TestMolProcessor.testMolProcess_05_1_50_None_False_None__a_1_()
TestMolProcessor.testMolProcess_06_1_50_None_False__1_2__None()
TestMolProcessor.testMolProcess_07_1_50_None_False__1_2___a_1_()
TestMolProcessor.testMolProcess_08_1_50__fu_CL__True_None_None()
TestMolProcessor.testMolProcess_09_1_50__fu_CL__True_None__a_1_()
TestMolProcessor.testMolProcess_10_1_50__fu_CL__True__1_2__None()
TestMolProcessor.testMolProcess_11_1_50__fu_CL__True__1_2___a_1_()
TestMolProcessor.testMolProcess_12_1_50__fu_CL__False_None_None()
TestMolProcessor.testMolProcess_13_1_50__fu_CL__False_None__a_1_()
TestMolProcessor.testMolProcess_14_1_50__fu_CL__False__1_2__None()
TestMolProcessor.testMolProcess_15_1_50__fu_CL__False__1_2___a_1_()
TestMolProcessor.testMolProcess_16_1_50__SMILES__True_None_None()
TestMolProcessor.testMolProcess_17_1_50__SMILES__True_None__a_1_()
TestMolProcessor.testMolProcess_18_1_50__SMILES__True__1_2__None()
TestMolProcessor.testMolProcess_19_1_50__SMILES__True__1_2___a_1_()
TestMolProcessor.testMolProcess_20_1_50__SMILES__False_None_None()
TestMolProcessor.testMolProcess_21_1_50__SMILES__False_None__a_1_()
TestMolProcessor.testMolProcess_22_1_50__SMILES__False__1_2__None()
TestMolProcessor.testMolProcess_23_1_50__SMILES__False__1_2___a_1_()
TestMolProcessor.testMolProcess_24_1_None_None_True_None_None()
TestMolProcessor.testMolProcess_25_1_None_None_True_None__a_1_()
TestMolProcessor.testMolProcess_26_1_None_None_True__1_2__None()
TestMolProcessor.testMolProcess_27_1_None_None_True__1_2___a_1_()
TestMolProcessor.testMolProcess_28_1_None_None_False_None_None()
TestMolProcessor.testMolProcess_29_1_None_None_False_None__a_1_()
TestMolProcessor.testMolProcess_30_1_None_None_False__1_2__None()
TestMolProcessor.testMolProcess_31_1_None_None_False__1_2___a_1_()
TestMolProcessor.testMolProcess_32_1_None__fu_CL__True_None_None()
TestMolProcessor.testMolProcess_33_1_None__fu_CL__True_None__a_1_()
TestMolProcessor.testMolProcess_34_1_None__fu_CL__True__1_2__None()
TestMolProcessor.testMolProcess_35_1_None__fu_CL__True__1_2___a_1_()
TestMolProcessor.testMolProcess_36_1_None__fu_CL__False_None_None()
TestMolProcessor.testMolProcess_37_1_None__fu_CL__False_None__a_1_()
TestMolProcessor.testMolProcess_38_1_None__fu_CL__False__1_2__None()
TestMolProcessor.testMolProcess_39_1_None__fu_CL__False__1_2___a_1_()
TestMolProcessor.testMolProcess_40_1_None__SMILES__True_None_None()
TestMolProcessor.testMolProcess_41_1_None__SMILES__True_None__a_1_()
TestMolProcessor.testMolProcess_42_1_None__SMILES__True__1_2__None()
TestMolProcessor.testMolProcess_43_1_None__SMILES__True__1_2___a_1_()
TestMolProcessor.testMolProcess_44_1_None__SMILES__False_None_None()
TestMolProcessor.testMolProcess_45_1_None__SMILES__False_None__a_1_()
TestMolProcessor.testMolProcess_46_1_None__SMILES__False__1_2__None()
TestMolProcessor.testMolProcess_47_1_None__SMILES__False__1_2___a_1_()
TestMolProcessor.testMolProcess_48_None_50_None_True_None_None()
TestMolProcessor.testMolProcess_49_None_50_None_True_None__a_1_()
TestMolProcessor.testMolProcess_50_None_50_None_True__1_2__None()
TestMolProcessor.testMolProcess_51_None_50_None_True__1_2___a_1_()
TestMolProcessor.testMolProcess_52_None_50_None_False_None_None()
TestMolProcessor.testMolProcess_53_None_50_None_False_None__a_1_()
TestMolProcessor.testMolProcess_54_None_50_None_False__1_2__None()
TestMolProcessor.testMolProcess_55_None_50_None_False__1_2___a_1_()
TestMolProcessor.testMolProcess_56_None_50__fu_CL__True_None_None()
TestMolProcessor.testMolProcess_57_None_50__fu_CL__True_None__a_1_()
TestMolProcessor.testMolProcess_58_None_50__fu_CL__True__1_2__None()
TestMolProcessor.testMolProcess_59_None_50__fu_CL__True__1_2___a_1_()
TestMolProcessor.testMolProcess_60_None_50__fu_CL__False_None_None()
TestMolProcessor.testMolProcess_61_None_50__fu_CL__False_None__a_1_()
TestMolProcessor.testMolProcess_62_None_50__fu_CL__False__1_2__None()
TestMolProcessor.testMolProcess_63_None_50__fu_CL__False__1_2___a_1_()
TestMolProcessor.testMolProcess_64_None_50__SMILES__True_None_None()
TestMolProcessor.testMolProcess_65_None_50__SMILES__True_None__a_1_()
TestMolProcessor.testMolProcess_66_None_50__SMILES__True__1_2__None()
TestMolProcessor.testMolProcess_67_None_50__SMILES__True__1_2___a_1_()
TestMolProcessor.testMolProcess_68_None_50__SMILES__False_None_None()
TestMolProcessor.testMolProcess_69_None_50__SMILES__False_None__a_1_()
TestMolProcessor.testMolProcess_70_None_50__SMILES__False__1_2__None()
TestMolProcessor.testMolProcess_71_None_50__SMILES__False__1_2___a_1_()
TestMolProcessor.testMolProcess_72_None_None_None_True_None_None()
TestMolProcessor.testMolProcess_73_None_None_None_True_None__a_1_()
TestMolProcessor.testMolProcess_74_None_None_None_True__1_2__None()
TestMolProcessor.testMolProcess_75_None_None_None_True__1_2___a_1_()
TestMolProcessor.testMolProcess_76_None_None_None_False_None_None()
TestMolProcessor.testMolProcess_77_None_None_None_False_None__a_1_()
TestMolProcessor.testMolProcess_78_None_None_None_False__1_2__None()
TestMolProcessor.testMolProcess_79_None_None_None_False__1_2___a_1_()
TestMolProcessor.testMolProcess_80_None_None__fu_CL__True_None_None()
TestMolProcessor.testMolProcess_81_None_None__fu_CL__True_None__a_1_()
TestMolProcessor.testMolProcess_82_None_None__fu_CL__True__1_2__None()
TestMolProcessor.testMolProcess_83_None_None__fu_CL__True__1_2___a_1_()
TestMolProcessor.testMolProcess_84_None_None__fu_CL__False_None_None()
TestMolProcessor.testMolProcess_85_None_None__fu_CL__False_None__a_1_()
TestMolProcessor.testMolProcess_86_None_None__fu_CL__False__1_2__None()
TestMolProcessor.testMolProcess_87_None_None__fu_CL__False__1_2___a_1_()
TestMolProcessor.testMolProcess_88_None_None__SMILES__True_None_None()
TestMolProcessor.testMolProcess_89_None_None__SMILES__True_None__a_1_()
TestMolProcessor.testMolProcess_90_None_None__SMILES__True__1_2__None()
TestMolProcessor.testMolProcess_91_None_None__SMILES__True__1_2___a_1_()
TestMolProcessor.testMolProcess_92_None_None__SMILES__False_None_None()
TestMolProcessor.testMolProcess_93_None_None__SMILES__False_None__a_1_()
TestMolProcessor.testMolProcess_94_None_None__SMILES__False__1_2__None()
TestMolProcessor.testMolProcess_95_None_None__SMILES__False__1_2___a_1_()
TestMolProcessor.validate_split()
getCombos()
testApplicabilityDomain
testApplicabilityDomain.addClassCleanup()
testApplicabilityDomain.addCleanup()
testApplicabilityDomain.addTypeEqualityFunc()
testApplicabilityDomain.assertAlmostEqual()
testApplicabilityDomain.assertCountEqual()
testApplicabilityDomain.assertDictEqual()
testApplicabilityDomain.assertEqual()
testApplicabilityDomain.assertFalse()
testApplicabilityDomain.assertGreater()
testApplicabilityDomain.assertGreaterEqual()
testApplicabilityDomain.assertIn()
testApplicabilityDomain.assertIs()
testApplicabilityDomain.assertIsInstance()
testApplicabilityDomain.assertIsNone()
testApplicabilityDomain.assertIsNot()
testApplicabilityDomain.assertIsNotNone()
testApplicabilityDomain.assertLess()
testApplicabilityDomain.assertLessEqual()
testApplicabilityDomain.assertListEqual()
testApplicabilityDomain.assertLogs()
testApplicabilityDomain.assertMultiLineEqual()
testApplicabilityDomain.assertNoLogs()
testApplicabilityDomain.assertNotAlmostEqual()
testApplicabilityDomain.assertNotEqual()
testApplicabilityDomain.assertNotIn()
testApplicabilityDomain.assertNotIsInstance()
testApplicabilityDomain.assertNotRegex()
testApplicabilityDomain.assertRaises()
testApplicabilityDomain.assertRaisesRegex()
testApplicabilityDomain.assertRegex()
testApplicabilityDomain.assertSequenceEqual()
testApplicabilityDomain.assertSetEqual()
testApplicabilityDomain.assertTrue()
testApplicabilityDomain.assertTupleEqual()
testApplicabilityDomain.assertWarns()
testApplicabilityDomain.assertWarnsRegex()
testApplicabilityDomain.clearGenerated()
testApplicabilityDomain.countTestCases()
testApplicabilityDomain.createLargeMultitaskDataSet()
testApplicabilityDomain.createLargeTestDataSet()
testApplicabilityDomain.createSmallTestDataSet()
testApplicabilityDomain.createTestDataSetFromFrame()
testApplicabilityDomain.debug()
testApplicabilityDomain.defaultTestResult()
testApplicabilityDomain.doClassCleanups()
testApplicabilityDomain.doCleanups()
testApplicabilityDomain.enterClassContext()
testApplicabilityDomain.enterContext()
testApplicabilityDomain.fail()
testApplicabilityDomain.failureException
testApplicabilityDomain.getAllDescriptors()
testApplicabilityDomain.getBigDF()
testApplicabilityDomain.getDataPrepGrid()
testApplicabilityDomain.getDefaultCalculatorCombo()
testApplicabilityDomain.getDefaultPrep()
testApplicabilityDomain.getPrepCombos()
testApplicabilityDomain.getSmallDF()
testApplicabilityDomain.id()
testApplicabilityDomain.longMessage
testApplicabilityDomain.maxDiff
testApplicabilityDomain.run()
testApplicabilityDomain.setUp()
testApplicabilityDomain.setUpClass()
testApplicabilityDomain.setUpPaths()
testApplicabilityDomain.shortDescription()
testApplicabilityDomain.skipTest()
testApplicabilityDomain.subTest()
testApplicabilityDomain.tearDown()
testApplicabilityDomain.tearDownClass()
testApplicabilityDomain.testApplicabilityDomain()
testApplicabilityDomain.testContinousAD()
testApplicabilityDomain.validate_split()
- Module contents
- qsprpred.data.sampling package
- Submodules
- qsprpred.data.sampling.folds module
- qsprpred.data.sampling.splits module
- qsprpred.data.sampling.tests module
TestDataSplitters
TestDataSplitters.addClassCleanup()
TestDataSplitters.addCleanup()
TestDataSplitters.addTypeEqualityFunc()
TestDataSplitters.assertAlmostEqual()
TestDataSplitters.assertCountEqual()
TestDataSplitters.assertDictEqual()
TestDataSplitters.assertEqual()
TestDataSplitters.assertFalse()
TestDataSplitters.assertGreater()
TestDataSplitters.assertGreaterEqual()
TestDataSplitters.assertIn()
TestDataSplitters.assertIs()
TestDataSplitters.assertIsInstance()
TestDataSplitters.assertIsNone()
TestDataSplitters.assertIsNot()
TestDataSplitters.assertIsNotNone()
TestDataSplitters.assertLess()
TestDataSplitters.assertLessEqual()
TestDataSplitters.assertListEqual()
TestDataSplitters.assertLogs()
TestDataSplitters.assertMultiLineEqual()
TestDataSplitters.assertNoLogs()
TestDataSplitters.assertNotAlmostEqual()
TestDataSplitters.assertNotEqual()
TestDataSplitters.assertNotIn()
TestDataSplitters.assertNotIsInstance()
TestDataSplitters.assertNotRegex()
TestDataSplitters.assertRaises()
TestDataSplitters.assertRaisesRegex()
TestDataSplitters.assertRegex()
TestDataSplitters.assertSequenceEqual()
TestDataSplitters.assertSetEqual()
TestDataSplitters.assertTrue()
TestDataSplitters.assertTupleEqual()
TestDataSplitters.assertWarns()
TestDataSplitters.assertWarnsRegex()
TestDataSplitters.clearGenerated()
TestDataSplitters.countTestCases()
TestDataSplitters.createLargeMultitaskDataSet()
TestDataSplitters.createLargeTestDataSet()
TestDataSplitters.createSmallTestDataSet()
TestDataSplitters.createTestDataSetFromFrame()
TestDataSplitters.debug()
TestDataSplitters.defaultTestResult()
TestDataSplitters.doClassCleanups()
TestDataSplitters.doCleanups()
TestDataSplitters.enterClassContext()
TestDataSplitters.enterContext()
TestDataSplitters.fail()
TestDataSplitters.failureException
TestDataSplitters.getAllDescriptors()
TestDataSplitters.getBigDF()
TestDataSplitters.getDataPrepGrid()
TestDataSplitters.getDefaultCalculatorCombo()
TestDataSplitters.getDefaultPrep()
TestDataSplitters.getPrepCombos()
TestDataSplitters.getSmallDF()
TestDataSplitters.id()
TestDataSplitters.longMessage
TestDataSplitters.maxDiff
TestDataSplitters.run()
TestDataSplitters.setUp()
TestDataSplitters.setUpClass()
TestDataSplitters.setUpPaths()
TestDataSplitters.shortDescription()
TestDataSplitters.skipTest()
TestDataSplitters.subTest()
TestDataSplitters.tearDown()
TestDataSplitters.tearDownClass()
TestDataSplitters.testClusterSplit
TestDataSplitters.testClusterSplit_0()
TestDataSplitters.testClusterSplit_1()
TestDataSplitters.testClusterSplit_2()
TestDataSplitters.testClusterSplit_3()
TestDataSplitters.testManualSplit()
TestDataSplitters.testRandomSplit
TestDataSplitters.testRandomSplit_0()
TestDataSplitters.testRandomSplit_1()
TestDataSplitters.testScaffoldSplit
TestDataSplitters.testScaffoldSplit_0()
TestDataSplitters.testScaffoldSplit_1()
TestDataSplitters.testScaffoldSplit_2()
TestDataSplitters.testSerialization()
TestDataSplitters.testTemporalSplit
TestDataSplitters.testTemporalSplit_0()
TestDataSplitters.testTemporalSplit_1()
TestDataSplitters.validate_split()
TestFoldSplitters
TestFoldSplitters.addClassCleanup()
TestFoldSplitters.addCleanup()
TestFoldSplitters.addTypeEqualityFunc()
TestFoldSplitters.assertAlmostEqual()
TestFoldSplitters.assertCountEqual()
TestFoldSplitters.assertDictEqual()
TestFoldSplitters.assertEqual()
TestFoldSplitters.assertFalse()
TestFoldSplitters.assertGreater()
TestFoldSplitters.assertGreaterEqual()
TestFoldSplitters.assertIn()
TestFoldSplitters.assertIs()
TestFoldSplitters.assertIsInstance()
TestFoldSplitters.assertIsNone()
TestFoldSplitters.assertIsNot()
TestFoldSplitters.assertIsNotNone()
TestFoldSplitters.assertLess()
TestFoldSplitters.assertLessEqual()
TestFoldSplitters.assertListEqual()
TestFoldSplitters.assertLogs()
TestFoldSplitters.assertMultiLineEqual()
TestFoldSplitters.assertNoLogs()
TestFoldSplitters.assertNotAlmostEqual()
TestFoldSplitters.assertNotEqual()
TestFoldSplitters.assertNotIn()
TestFoldSplitters.assertNotIsInstance()
TestFoldSplitters.assertNotRegex()
TestFoldSplitters.assertRaises()
TestFoldSplitters.assertRaisesRegex()
TestFoldSplitters.assertRegex()
TestFoldSplitters.assertSequenceEqual()
TestFoldSplitters.assertSetEqual()
TestFoldSplitters.assertTrue()
TestFoldSplitters.assertTupleEqual()
TestFoldSplitters.assertWarns()
TestFoldSplitters.assertWarnsRegex()
TestFoldSplitters.clearGenerated()
TestFoldSplitters.countTestCases()
TestFoldSplitters.createLargeMultitaskDataSet()
TestFoldSplitters.createLargeTestDataSet()
TestFoldSplitters.createSmallTestDataSet()
TestFoldSplitters.createTestDataSetFromFrame()
TestFoldSplitters.debug()
TestFoldSplitters.defaultTestResult()
TestFoldSplitters.doClassCleanups()
TestFoldSplitters.doCleanups()
TestFoldSplitters.enterClassContext()
TestFoldSplitters.enterContext()
TestFoldSplitters.fail()
TestFoldSplitters.failureException
TestFoldSplitters.getAllDescriptors()
TestFoldSplitters.getBigDF()
TestFoldSplitters.getDataPrepGrid()
TestFoldSplitters.getDefaultCalculatorCombo()
TestFoldSplitters.getDefaultPrep()
TestFoldSplitters.getPrepCombos()
TestFoldSplitters.getSmallDF()
TestFoldSplitters.id()
TestFoldSplitters.longMessage
TestFoldSplitters.maxDiff
TestFoldSplitters.run()
TestFoldSplitters.setUp()
TestFoldSplitters.setUpClass()
TestFoldSplitters.setUpPaths()
TestFoldSplitters.shortDescription()
TestFoldSplitters.skipTest()
TestFoldSplitters.subTest()
TestFoldSplitters.tearDown()
TestFoldSplitters.tearDownClass()
TestFoldSplitters.testBootstrappedFold()
TestFoldSplitters.testStandardFolds()
TestFoldSplitters.validateFolds()
TestFoldSplitters.validate_split()
- Module contents
- qsprpred.data.sources package
- qsprpred.data.tables package
- Submodules
- qsprpred.data.tables.base module
DataSetDependant
DataTable
MoleculeDataTable
MoleculeDataTable.addDescriptors()
MoleculeDataTable.addProperty()
MoleculeDataTable.apply()
MoleculeDataTable.clearFiles()
MoleculeDataTable.filter()
MoleculeDataTable.fromFile()
MoleculeDataTable.getDescriptorNames()
MoleculeDataTable.getDescriptors()
MoleculeDataTable.getProperties()
MoleculeDataTable.getProperty()
MoleculeDataTable.getSubset()
MoleculeDataTable.hasDescriptors()
MoleculeDataTable.reload()
MoleculeDataTable.removeProperty()
MoleculeDataTable.save()
MoleculeDataTable.smiles
MoleculeDataTable.transformProperties()
StoredTable
- qsprpred.data.tables.mol module
DescriptorTable
DescriptorTable.addProperty()
DescriptorTable.apply()
DescriptorTable.baseDir
DescriptorTable.chunkSize
DescriptorTable.clearFiles()
DescriptorTable.dropEmptyProperties()
DescriptorTable.fillMissing()
DescriptorTable.filter()
DescriptorTable.fromFile()
DescriptorTable.fromJSON()
DescriptorTable.generateIndex()
DescriptorTable.getDF()
DescriptorTable.getDescriptorNames()
DescriptorTable.getDescriptors()
DescriptorTable.getProperties()
DescriptorTable.getProperty()
DescriptorTable.getSubset()
DescriptorTable.hasProperty()
DescriptorTable.imputeProperties()
DescriptorTable.iterChunks()
DescriptorTable.keepDescriptors()
DescriptorTable.metaFile
DescriptorTable.nJobs
DescriptorTable.reload()
DescriptorTable.removeProperty()
DescriptorTable.restoreDescriptors()
DescriptorTable.save()
DescriptorTable.setIndex()
DescriptorTable.setRandomState()
DescriptorTable.shuffle()
DescriptorTable.storeDir
DescriptorTable.storePath
DescriptorTable.storePrefix
DescriptorTable.toFile()
DescriptorTable.toJSON()
DescriptorTable.transformProperties()
MoleculeTable
MoleculeTable.addClusters()
MoleculeTable.addDescriptors()
MoleculeTable.addProperty()
MoleculeTable.addScaffolds()
MoleculeTable.apply()
MoleculeTable.attachDescriptors()
MoleculeTable.baseDir
MoleculeTable.checkMols()
MoleculeTable.chunkSize
MoleculeTable.clearFiles()
MoleculeTable.createScaffoldGroups()
MoleculeTable.descriptorSets
MoleculeTable.dropDescriptorSets()
MoleculeTable.dropDescriptors()
MoleculeTable.dropEmptyProperties()
MoleculeTable.dropEmptySmiles()
MoleculeTable.dropInvalids()
MoleculeTable.filter()
MoleculeTable.fromFile()
MoleculeTable.fromJSON()
MoleculeTable.fromSDF()
MoleculeTable.fromSMILES()
MoleculeTable.fromTableFile()
MoleculeTable.generateDescriptorDataSetName()
MoleculeTable.generateIndex()
MoleculeTable.getClusterNames()
MoleculeTable.getClusters()
MoleculeTable.getDF()
MoleculeTable.getDescriptorNames()
MoleculeTable.getDescriptors()
MoleculeTable.getProperties()
MoleculeTable.getProperty()
MoleculeTable.getScaffoldGroups()
MoleculeTable.getScaffoldNames()
MoleculeTable.getScaffolds()
MoleculeTable.getSubset()
MoleculeTable.getSummary()
MoleculeTable.hasClusters
MoleculeTable.hasDescriptors()
MoleculeTable.hasProperty()
MoleculeTable.hasScaffoldGroups
MoleculeTable.hasScaffolds
MoleculeTable.imputeProperties()
MoleculeTable.iterChunks()
MoleculeTable.metaFile
MoleculeTable.nJobs
MoleculeTable.processMols()
MoleculeTable.reload()
MoleculeTable.removeProperty()
MoleculeTable.restoreDescriptorSets()
MoleculeTable.runMolProcess()
MoleculeTable.sample()
MoleculeTable.save()
MoleculeTable.searchOnProperty()
MoleculeTable.searchWithIndex()
MoleculeTable.searchWithSMARTS()
MoleculeTable.setIndex()
MoleculeTable.setRandomState()
MoleculeTable.shuffle()
MoleculeTable.smiles
MoleculeTable.standardizeSmiles()
MoleculeTable.storeDir
MoleculeTable.storePath
MoleculeTable.storePrefix
MoleculeTable.toFile()
MoleculeTable.toJSON()
MoleculeTable.transformProperties()
- qsprpred.data.tables.pandas module
PandasDataTable
PandasDataTable.addProperty()
PandasDataTable.apply()
PandasDataTable.baseDir
PandasDataTable.chunkSize
PandasDataTable.clearFiles()
PandasDataTable.dropEmptyProperties()
PandasDataTable.filter()
PandasDataTable.fromFile()
PandasDataTable.fromJSON()
PandasDataTable.generateIndex()
PandasDataTable.getDF()
PandasDataTable.getProperties()
PandasDataTable.getProperty()
PandasDataTable.getSubset()
PandasDataTable.hasProperty()
PandasDataTable.imputeProperties()
PandasDataTable.iterChunks()
PandasDataTable.metaFile
PandasDataTable.nJobs
PandasDataTable.reload()
PandasDataTable.removeProperty()
PandasDataTable.save()
PandasDataTable.setIndex()
PandasDataTable.setRandomState()
PandasDataTable.shuffle()
PandasDataTable.storeDir
PandasDataTable.storePath
PandasDataTable.storePrefix
PandasDataTable.toFile()
PandasDataTable.toJSON()
PandasDataTable.transformProperties()
- qsprpred.data.tables.qspr module
QSPRDataset
QSPRDataset.addClusters()
QSPRDataset.addDescriptors()
QSPRDataset.addFeatures()
QSPRDataset.addProperty()
QSPRDataset.addScaffolds()
QSPRDataset.apply()
QSPRDataset.attachDescriptors()
QSPRDataset.baseDir
QSPRDataset.checkFeatures()
QSPRDataset.checkMols()
QSPRDataset.chunkSize
QSPRDataset.clearFiles()
QSPRDataset.createScaffoldGroups()
QSPRDataset.descriptorSets
QSPRDataset.dropDescriptorSets()
QSPRDataset.dropDescriptors()
QSPRDataset.dropEmptyProperties()
QSPRDataset.dropEmptySmiles()
QSPRDataset.dropInvalids()
QSPRDataset.dropOutliers()
QSPRDataset.featurize()
QSPRDataset.featurizeSplits()
QSPRDataset.fillMissing()
QSPRDataset.filter()
QSPRDataset.filterFeatures()
QSPRDataset.fromFile()
QSPRDataset.fromJSON()
QSPRDataset.fromMolTable()
QSPRDataset.fromSDF()
QSPRDataset.fromSMILES()
QSPRDataset.fromTableFile()
QSPRDataset.generateDescriptorDataSetName()
QSPRDataset.generateIndex()
QSPRDataset.getApplicability()
QSPRDataset.getClusterNames()
QSPRDataset.getClusters()
QSPRDataset.getDF()
QSPRDataset.getDescriptorNames()
QSPRDataset.getDescriptors()
QSPRDataset.getFeatureNames()
QSPRDataset.getFeatures()
QSPRDataset.getProperties()
QSPRDataset.getProperty()
QSPRDataset.getScaffoldGroups()
QSPRDataset.getScaffoldNames()
QSPRDataset.getScaffolds()
QSPRDataset.getSubset()
QSPRDataset.getSummary()
QSPRDataset.getTargetProperties()
QSPRDataset.getTargetPropertiesValues()
QSPRDataset.hasClusters
QSPRDataset.hasDescriptors()
QSPRDataset.hasFeatures
QSPRDataset.hasProperty()
QSPRDataset.hasScaffoldGroups
QSPRDataset.hasScaffolds
QSPRDataset.imputeProperties()
QSPRDataset.isMultiTask
QSPRDataset.iterChunks()
QSPRDataset.iterFolds()
QSPRDataset.loadDescriptorsToSplits()
QSPRDataset.makeClassification()
QSPRDataset.makeRegression()
QSPRDataset.metaFile
QSPRDataset.nJobs
QSPRDataset.nTargetProperties
QSPRDataset.prepareDataset()
QSPRDataset.processMols()
QSPRDataset.reload()
QSPRDataset.removeProperty()
QSPRDataset.reset()
QSPRDataset.resetTargetProperty()
QSPRDataset.restoreDescriptorSets()
QSPRDataset.restoreTrainingData()
QSPRDataset.runMolProcess()
QSPRDataset.sample()
QSPRDataset.save()
QSPRDataset.saveSplit()
QSPRDataset.searchOnProperty()
QSPRDataset.searchWithIndex()
QSPRDataset.searchWithSMARTS()
QSPRDataset.setApplicabilityDomain()
QSPRDataset.setFeatureStandardizer()
QSPRDataset.setIndex()
QSPRDataset.setRandomState()
QSPRDataset.setTargetProperties()
QSPRDataset.setTargetProperty()
QSPRDataset.shuffle()
QSPRDataset.smiles
QSPRDataset.split()
QSPRDataset.standardizeSmiles()
QSPRDataset.storeDir
QSPRDataset.storePath
QSPRDataset.storePrefix
QSPRDataset.targetPropertyNames
QSPRDataset.toFile()
QSPRDataset.toJSON()
QSPRDataset.transformProperties()
QSPRDataset.unsetTargetProperty()
- qsprpred.data.tables.searchable module
SearchableMolTable
SearchableMolTable.addDescriptors()
SearchableMolTable.addProperty()
SearchableMolTable.apply()
SearchableMolTable.clearFiles()
SearchableMolTable.filter()
SearchableMolTable.fromFile()
SearchableMolTable.getDescriptorNames()
SearchableMolTable.getDescriptors()
SearchableMolTable.getProperties()
SearchableMolTable.getProperty()
SearchableMolTable.getSubset()
SearchableMolTable.hasDescriptors()
SearchableMolTable.reload()
SearchableMolTable.removeProperty()
SearchableMolTable.save()
SearchableMolTable.searchOnProperty()
SearchableMolTable.searchWithSMARTS()
SearchableMolTable.smiles
SearchableMolTable.transformProperties()
- qsprpred.data.tables.tests module
TestApply
TestApply.addClassCleanup()
TestApply.addCleanup()
TestApply.addTypeEqualityFunc()
TestApply.assertAlmostEqual()
TestApply.assertCountEqual()
TestApply.assertDictEqual()
TestApply.assertEqual()
TestApply.assertFalse()
TestApply.assertGreater()
TestApply.assertGreaterEqual()
TestApply.assertIn()
TestApply.assertIs()
TestApply.assertIsInstance()
TestApply.assertIsNone()
TestApply.assertIsNot()
TestApply.assertIsNotNone()
TestApply.assertLess()
TestApply.assertLessEqual()
TestApply.assertListEqual()
TestApply.assertLogs()
TestApply.assertMultiLineEqual()
TestApply.assertNoLogs()
TestApply.assertNotAlmostEqual()
TestApply.assertNotEqual()
TestApply.assertNotIn()
TestApply.assertNotIsInstance()
TestApply.assertNotRegex()
TestApply.assertRaises()
TestApply.assertRaisesRegex()
TestApply.assertRegex()
TestApply.assertSequenceEqual()
TestApply.assertSetEqual()
TestApply.assertTrue()
TestApply.assertTupleEqual()
TestApply.assertWarns()
TestApply.assertWarnsRegex()
TestApply.clearGenerated()
TestApply.countTestCases()
TestApply.createLargeMultitaskDataSet()
TestApply.createLargeTestDataSet()
TestApply.createSmallTestDataSet()
TestApply.createTestDataSetFromFrame()
TestApply.debug()
TestApply.defaultTestResult()
TestApply.doClassCleanups()
TestApply.doCleanups()
TestApply.enterClassContext()
TestApply.enterContext()
TestApply.fail()
TestApply.failureException
TestApply.getAllDescriptors()
TestApply.getBigDF()
TestApply.getDataPrepGrid()
TestApply.getDefaultCalculatorCombo()
TestApply.getDefaultPrep()
TestApply.getPrepCombos()
TestApply.getSmallDF()
TestApply.id()
TestApply.longMessage
TestApply.maxDiff
TestApply.regularFunc()
TestApply.run()
TestApply.setUp()
TestApply.setUpClass()
TestApply.setUpPaths()
TestApply.shortDescription()
TestApply.skipTest()
TestApply.subTest()
TestApply.tearDown()
TestApply.tearDownClass()
TestApply.testRegular
TestApply.testRegular_0()
TestApply.testRegular_1()
TestApply.testRegular_2()
TestApply.testRegular_3()
TestApply.validate_split()
TestDataSetCreationAndSerialization
TestDataSetCreationAndSerialization.addClassCleanup()
TestDataSetCreationAndSerialization.addCleanup()
TestDataSetCreationAndSerialization.addTypeEqualityFunc()
TestDataSetCreationAndSerialization.assertAlmostEqual()
TestDataSetCreationAndSerialization.assertCountEqual()
TestDataSetCreationAndSerialization.assertDictEqual()
TestDataSetCreationAndSerialization.assertEqual()
TestDataSetCreationAndSerialization.assertFalse()
TestDataSetCreationAndSerialization.assertGreater()
TestDataSetCreationAndSerialization.assertGreaterEqual()
TestDataSetCreationAndSerialization.assertIn()
TestDataSetCreationAndSerialization.assertIs()
TestDataSetCreationAndSerialization.assertIsInstance()
TestDataSetCreationAndSerialization.assertIsNone()
TestDataSetCreationAndSerialization.assertIsNot()
TestDataSetCreationAndSerialization.assertIsNotNone()
TestDataSetCreationAndSerialization.assertLess()
TestDataSetCreationAndSerialization.assertLessEqual()
TestDataSetCreationAndSerialization.assertListEqual()
TestDataSetCreationAndSerialization.assertLogs()
TestDataSetCreationAndSerialization.assertMultiLineEqual()
TestDataSetCreationAndSerialization.assertNoLogs()
TestDataSetCreationAndSerialization.assertNotAlmostEqual()
TestDataSetCreationAndSerialization.assertNotEqual()
TestDataSetCreationAndSerialization.assertNotIn()
TestDataSetCreationAndSerialization.assertNotIsInstance()
TestDataSetCreationAndSerialization.assertNotRegex()
TestDataSetCreationAndSerialization.assertRaises()
TestDataSetCreationAndSerialization.assertRaisesRegex()
TestDataSetCreationAndSerialization.assertRegex()
TestDataSetCreationAndSerialization.assertSequenceEqual()
TestDataSetCreationAndSerialization.assertSetEqual()
TestDataSetCreationAndSerialization.assertTrue()
TestDataSetCreationAndSerialization.assertTupleEqual()
TestDataSetCreationAndSerialization.assertWarns()
TestDataSetCreationAndSerialization.assertWarnsRegex()
TestDataSetCreationAndSerialization.checkBadInit()
TestDataSetCreationAndSerialization.checkClassification()
TestDataSetCreationAndSerialization.checkConsistency()
TestDataSetCreationAndSerialization.checkConsistencyMulticlass()
TestDataSetCreationAndSerialization.checkConsistencySingleclass()
TestDataSetCreationAndSerialization.checkRegression()
TestDataSetCreationAndSerialization.clearGenerated()
TestDataSetCreationAndSerialization.countTestCases()
TestDataSetCreationAndSerialization.createLargeMultitaskDataSet()
TestDataSetCreationAndSerialization.createLargeTestDataSet()
TestDataSetCreationAndSerialization.createSmallTestDataSet()
TestDataSetCreationAndSerialization.createTestDataSetFromFrame()
TestDataSetCreationAndSerialization.debug()
TestDataSetCreationAndSerialization.defaultTestResult()
TestDataSetCreationAndSerialization.doClassCleanups()
TestDataSetCreationAndSerialization.doCleanups()
TestDataSetCreationAndSerialization.enterClassContext()
TestDataSetCreationAndSerialization.enterContext()
TestDataSetCreationAndSerialization.fail()
TestDataSetCreationAndSerialization.failureException
TestDataSetCreationAndSerialization.getAllDescriptors()
TestDataSetCreationAndSerialization.getBigDF()
TestDataSetCreationAndSerialization.getDataPrepGrid()
TestDataSetCreationAndSerialization.getDefaultCalculatorCombo()
TestDataSetCreationAndSerialization.getDefaultPrep()
TestDataSetCreationAndSerialization.getPrepCombos()
TestDataSetCreationAndSerialization.getSmallDF()
TestDataSetCreationAndSerialization.id()
TestDataSetCreationAndSerialization.longMessage
TestDataSetCreationAndSerialization.maxDiff
TestDataSetCreationAndSerialization.run()
TestDataSetCreationAndSerialization.setUp()
TestDataSetCreationAndSerialization.setUpClass()
TestDataSetCreationAndSerialization.setUpPaths()
TestDataSetCreationAndSerialization.shortDescription()
TestDataSetCreationAndSerialization.skipTest()
TestDataSetCreationAndSerialization.subTest()
TestDataSetCreationAndSerialization.tearDown()
TestDataSetCreationAndSerialization.tearDownClass()
TestDataSetCreationAndSerialization.testDefaults()
TestDataSetCreationAndSerialization.testIndexing()
TestDataSetCreationAndSerialization.testInvalidsDetection
TestDataSetCreationAndSerialization.testInvalidsDetection_0()
TestDataSetCreationAndSerialization.testInvalidsDetection_1()
TestDataSetCreationAndSerialization.testMultitask()
TestDataSetCreationAndSerialization.testRandomStateFeaturization()
TestDataSetCreationAndSerialization.testRandomStateFolds()
TestDataSetCreationAndSerialization.testRandomStateShuffle()
TestDataSetCreationAndSerialization.testTargetProperty()
TestDataSetCreationAndSerialization.validate_split()
TestDataSetPreparation
TestDataSetPreparation.addClassCleanup()
TestDataSetPreparation.addCleanup()
TestDataSetPreparation.addTypeEqualityFunc()
TestDataSetPreparation.assertAlmostEqual()
TestDataSetPreparation.assertCountEqual()
TestDataSetPreparation.assertDictEqual()
TestDataSetPreparation.assertEqual()
TestDataSetPreparation.assertFalse()
TestDataSetPreparation.assertGreater()
TestDataSetPreparation.assertGreaterEqual()
TestDataSetPreparation.assertIn()
TestDataSetPreparation.assertIs()
TestDataSetPreparation.assertIsInstance()
TestDataSetPreparation.assertIsNone()
TestDataSetPreparation.assertIsNot()
TestDataSetPreparation.assertIsNotNone()
TestDataSetPreparation.assertLess()
TestDataSetPreparation.assertLessEqual()
TestDataSetPreparation.assertListEqual()
TestDataSetPreparation.assertLogs()
TestDataSetPreparation.assertMultiLineEqual()
TestDataSetPreparation.assertNoLogs()
TestDataSetPreparation.assertNotAlmostEqual()
TestDataSetPreparation.assertNotEqual()
TestDataSetPreparation.assertNotIn()
TestDataSetPreparation.assertNotIsInstance()
TestDataSetPreparation.assertNotRegex()
TestDataSetPreparation.assertRaises()
TestDataSetPreparation.assertRaisesRegex()
TestDataSetPreparation.assertRegex()
TestDataSetPreparation.assertSequenceEqual()
TestDataSetPreparation.assertSetEqual()
TestDataSetPreparation.assertTrue()
TestDataSetPreparation.assertTupleEqual()
TestDataSetPreparation.assertWarns()
TestDataSetPreparation.assertWarnsRegex()
TestDataSetPreparation.checkDescriptors()
TestDataSetPreparation.checkFeatures()
TestDataSetPreparation.checkPrep()
TestDataSetPreparation.clearGenerated()
TestDataSetPreparation.countTestCases()
TestDataSetPreparation.createLargeMultitaskDataSet()
TestDataSetPreparation.createLargeTestDataSet()
TestDataSetPreparation.createSmallTestDataSet()
TestDataSetPreparation.createTestDataSetFromFrame()
TestDataSetPreparation.debug()
TestDataSetPreparation.defaultTestResult()
TestDataSetPreparation.doClassCleanups()
TestDataSetPreparation.doCleanups()
TestDataSetPreparation.enterClassContext()
TestDataSetPreparation.enterContext()
TestDataSetPreparation.fail()
TestDataSetPreparation.failureException
TestDataSetPreparation.getAllDescriptors()
TestDataSetPreparation.getBigDF()
TestDataSetPreparation.getDataPrepGrid()
TestDataSetPreparation.getDefaultCalculatorCombo()
TestDataSetPreparation.getDefaultPrep()
TestDataSetPreparation.getPrepCombos()
TestDataSetPreparation.getSmallDF()
TestDataSetPreparation.id()
TestDataSetPreparation.longMessage
TestDataSetPreparation.maxDiff
TestDataSetPreparation.run()
TestDataSetPreparation.setUp()
TestDataSetPreparation.setUpClass()
TestDataSetPreparation.setUpPaths()
TestDataSetPreparation.shortDescription()
TestDataSetPreparation.skipTest()
TestDataSetPreparation.subTest()
TestDataSetPreparation.tearDown()
TestDataSetPreparation.tearDownClass()
TestDataSetPreparation.testPrepCombos
TestDataSetPreparation.testPrepCombos_00_MorganFP_None_None_None_None_None()
TestDataSetPreparation.testPrepCombos_01_MorganFP_None_None_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_02_MorganFP_None_None_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_03_MorganFP_None_None_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_04_MorganFP_None_None_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_05_MorganFP_None_None_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_06_MorganFP_None_None_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_07_MorganFP_None_None_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_08_MorganFP_None_StandardScaler_None_None_None()
TestDataSetPreparation.testPrepCombos_09_MorganFP_None_StandardScaler_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_10_MorganFP_None_StandardScaler_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_11_MorganFP_None_StandardScaler_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_12_MorganFP_None_StandardScaler_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_13_MorganFP_None_StandardScaler_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_14_MorganFP_None_StandardScaler_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_15_MorganFP_None_StandardScaler_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_16_MorganFP_RandomSplit_None_None_None_None()
TestDataSetPreparation.testPrepCombos_17_MorganFP_RandomSplit_None_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_18_MorganFP_RandomSplit_None_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_19_MorganFP_RandomSplit_None_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_20_MorganFP_RandomSplit_None_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_21_MorganFP_RandomSplit_None_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_22_MorganFP_RandomSplit_None_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_23_MorganFP_RandomSplit_None_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_24_MorganFP_RandomSplit_StandardScaler_None_None_None()
TestDataSetPreparation.testPrepCombos_25_MorganFP_RandomSplit_StandardScaler_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_26_MorganFP_RandomSplit_StandardScaler_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_27_MorganFP_RandomSplit_StandardScaler_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_28_MorganFP_RandomSplit_StandardScaler_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_29_MorganFP_RandomSplit_StandardScaler_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_30_MorganFP_RandomSplit_StandardScaler_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_31_MorganFP_RandomSplit_StandardScaler_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_32_RDKitDescs_None_None_None_None_None()
TestDataSetPreparation.testPrepCombos_33_RDKitDescs_None_None_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_34_RDKitDescs_None_None_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_35_RDKitDescs_None_None_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_36_RDKitDescs_None_None_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_37_RDKitDescs_None_None_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_38_RDKitDescs_None_None_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_39_RDKitDescs_None_None_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_40_RDKitDescs_None_StandardScaler_None_None_None()
TestDataSetPreparation.testPrepCombos_41_RDKitDescs_None_StandardScaler_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_42_RDKitDescs_None_StandardScaler_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_43_RDKitDescs_None_StandardScaler_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_44_RDKitDescs_None_StandardScaler_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_45_RDKitDescs_None_StandardScaler_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_46_RDKitDescs_None_StandardScaler_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_47_RDKitDescs_None_StandardScaler_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_48_RDKitDescs_RandomSplit_None_None_None_None()
TestDataSetPreparation.testPrepCombos_49_RDKitDescs_RandomSplit_None_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_50_RDKitDescs_RandomSplit_None_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_51_RDKitDescs_RandomSplit_None_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_52_RDKitDescs_RandomSplit_None_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_53_RDKitDescs_RandomSplit_None_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_54_RDKitDescs_RandomSplit_None_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_55_RDKitDescs_RandomSplit_None_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_56_RDKitDescs_RandomSplit_StandardScaler_None_None_None()
TestDataSetPreparation.testPrepCombos_57_RDKitDescs_RandomSplit_StandardScaler_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_58_RDKitDescs_RandomSplit_StandardScaler_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_59_RDKitDescs_RandomSplit_StandardScaler_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_60_RDKitDescs_RandomSplit_StandardScaler_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_61_RDKitDescs_RandomSplit_StandardScaler_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_62_RDKitDescs_RandomSplit_StandardScaler_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_63_RDKitDescs_RandomSplit_StandardScaler_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_64_MorganFP_RDKitDescs_None_None_None_None_None()
TestDataSetPreparation.testPrepCombos_65_MorganFP_RDKitDescs_None_None_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_66_MorganFP_RDKitDescs_None_None_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_67_MorganFP_RDKitDescs_None_None_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_68_MorganFP_RDKitDescs_None_None_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_69_MorganFP_RDKitDescs_None_None_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_70_MorganFP_RDKitDescs_None_None_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_71_MorganFP_RDKitDescs_None_None_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_72_MorganFP_RDKitDescs_None_StandardScaler_None_None_None()
TestDataSetPreparation.testPrepCombos_73_MorganFP_RDKitDescs_None_StandardScaler_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_74_MorganFP_RDKitDescs_None_StandardScaler_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_75_MorganFP_RDKitDescs_None_StandardScaler_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_76_MorganFP_RDKitDescs_None_StandardScaler_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_77_MorganFP_RDKitDescs_None_StandardScaler_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_78_MorganFP_RDKitDescs_None_StandardScaler_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_79_MorganFP_RDKitDescs_None_StandardScaler_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_80_MorganFP_RDKitDescs_RandomSplit_None_None_None_None()
TestDataSetPreparation.testPrepCombos_81_MorganFP_RDKitDescs_RandomSplit_None_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_82_MorganFP_RDKitDescs_RandomSplit_None_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_83_MorganFP_RDKitDescs_RandomSplit_None_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_84_MorganFP_RDKitDescs_RandomSplit_None_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_85_MorganFP_RDKitDescs_RandomSplit_None_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_86_MorganFP_RDKitDescs_RandomSplit_None_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_87_MorganFP_RDKitDescs_RandomSplit_None_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_88_MorganFP_RDKitDescs_RandomSplit_StandardScaler_None_None_None()
TestDataSetPreparation.testPrepCombos_89_MorganFP_RDKitDescs_RandomSplit_StandardScaler_None_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_90_MorganFP_RDKitDescs_RandomSplit_StandardScaler_None_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_91_MorganFP_RDKitDescs_RandomSplit_StandardScaler_None_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_92_MorganFP_RDKitDescs_RandomSplit_StandardScaler_HighCorrelationFilter_None_None()
TestDataSetPreparation.testPrepCombos_93_MorganFP_RDKitDescs_RandomSplit_StandardScaler_HighCorrelationFilter_None_TopKatApplicabilityDomain()
TestDataSetPreparation.testPrepCombos_94_MorganFP_RDKitDescs_RandomSplit_StandardScaler_HighCorrelationFilter_RepeatsFilter_None()
TestDataSetPreparation.testPrepCombos_95_MorganFP_RDKitDescs_RandomSplit_StandardScaler_HighCorrelationFilter_RepeatsFilter_TopKatApplicabilityDomain()
TestDataSetPreparation.validate_split()
TestSearchFeatures
TestSearchFeatures.addClassCleanup()
TestSearchFeatures.addCleanup()
TestSearchFeatures.addTypeEqualityFunc()
TestSearchFeatures.assertAlmostEqual()
TestSearchFeatures.assertCountEqual()
TestSearchFeatures.assertDictEqual()
TestSearchFeatures.assertEqual()
TestSearchFeatures.assertFalse()
TestSearchFeatures.assertGreater()
TestSearchFeatures.assertGreaterEqual()
TestSearchFeatures.assertIn()
TestSearchFeatures.assertIs()
TestSearchFeatures.assertIsInstance()
TestSearchFeatures.assertIsNone()
TestSearchFeatures.assertIsNot()
TestSearchFeatures.assertIsNotNone()
TestSearchFeatures.assertLess()
TestSearchFeatures.assertLessEqual()
TestSearchFeatures.assertListEqual()
TestSearchFeatures.assertLogs()
TestSearchFeatures.assertMultiLineEqual()
TestSearchFeatures.assertNoLogs()
TestSearchFeatures.assertNotAlmostEqual()
TestSearchFeatures.assertNotEqual()
TestSearchFeatures.assertNotIn()
TestSearchFeatures.assertNotIsInstance()
TestSearchFeatures.assertNotRegex()
TestSearchFeatures.assertRaises()
TestSearchFeatures.assertRaisesRegex()
TestSearchFeatures.assertRegex()
TestSearchFeatures.assertSequenceEqual()
TestSearchFeatures.assertSetEqual()
TestSearchFeatures.assertTrue()
TestSearchFeatures.assertTupleEqual()
TestSearchFeatures.assertWarns()
TestSearchFeatures.assertWarnsRegex()
TestSearchFeatures.clearGenerated()
TestSearchFeatures.countTestCases()
TestSearchFeatures.createLargeMultitaskDataSet()
TestSearchFeatures.createLargeTestDataSet()
TestSearchFeatures.createSmallTestDataSet()
TestSearchFeatures.createTestDataSetFromFrame()
TestSearchFeatures.debug()
TestSearchFeatures.defaultTestResult()
TestSearchFeatures.doClassCleanups()
TestSearchFeatures.doCleanups()
TestSearchFeatures.enterClassContext()
TestSearchFeatures.enterContext()
TestSearchFeatures.fail()
TestSearchFeatures.failureException
TestSearchFeatures.getAllDescriptors()
TestSearchFeatures.getBigDF()
TestSearchFeatures.getDataPrepGrid()
TestSearchFeatures.getDefaultCalculatorCombo()
TestSearchFeatures.getDefaultPrep()
TestSearchFeatures.getPrepCombos()
TestSearchFeatures.getSmallDF()
TestSearchFeatures.id()
TestSearchFeatures.longMessage
TestSearchFeatures.maxDiff
TestSearchFeatures.run()
TestSearchFeatures.setUp()
TestSearchFeatures.setUpClass()
TestSearchFeatures.setUpPaths()
TestSearchFeatures.shortDescription()
TestSearchFeatures.skipTest()
TestSearchFeatures.subTest()
TestSearchFeatures.tearDown()
TestSearchFeatures.tearDownClass()
TestSearchFeatures.testPropSearch()
TestSearchFeatures.testSMARTS()
TestSearchFeatures.validateSearch()
TestSearchFeatures.validate_split()
TestTargetImputation
TestTargetImputation.addClassCleanup()
TestTargetImputation.addCleanup()
TestTargetImputation.addTypeEqualityFunc()
TestTargetImputation.assertAlmostEqual()
TestTargetImputation.assertCountEqual()
TestTargetImputation.assertDictEqual()
TestTargetImputation.assertEqual()
TestTargetImputation.assertFalse()
TestTargetImputation.assertGreater()
TestTargetImputation.assertGreaterEqual()
TestTargetImputation.assertIn()
TestTargetImputation.assertIs()
TestTargetImputation.assertIsInstance()
TestTargetImputation.assertIsNone()
TestTargetImputation.assertIsNot()
TestTargetImputation.assertIsNotNone()
TestTargetImputation.assertLess()
TestTargetImputation.assertLessEqual()
TestTargetImputation.assertListEqual()
TestTargetImputation.assertLogs()
TestTargetImputation.assertMultiLineEqual()
TestTargetImputation.assertNoLogs()
TestTargetImputation.assertNotAlmostEqual()
TestTargetImputation.assertNotEqual()
TestTargetImputation.assertNotIn()
TestTargetImputation.assertNotIsInstance()
TestTargetImputation.assertNotRegex()
TestTargetImputation.assertRaises()
TestTargetImputation.assertRaisesRegex()
TestTargetImputation.assertRegex()
TestTargetImputation.assertSequenceEqual()
TestTargetImputation.assertSetEqual()
TestTargetImputation.assertTrue()
TestTargetImputation.assertTupleEqual()
TestTargetImputation.assertWarns()
TestTargetImputation.assertWarnsRegex()
TestTargetImputation.clearGenerated()
TestTargetImputation.countTestCases()
TestTargetImputation.debug()
TestTargetImputation.defaultTestResult()
TestTargetImputation.doClassCleanups()
TestTargetImputation.doCleanups()
TestTargetImputation.enterClassContext()
TestTargetImputation.enterContext()
TestTargetImputation.fail()
TestTargetImputation.failureException
TestTargetImputation.id()
TestTargetImputation.longMessage
TestTargetImputation.maxDiff
TestTargetImputation.run()
TestTargetImputation.setUp()
TestTargetImputation.setUpClass()
TestTargetImputation.setUpPaths()
TestTargetImputation.shortDescription()
TestTargetImputation.skipTest()
TestTargetImputation.subTest()
TestTargetImputation.tearDown()
TestTargetImputation.tearDownClass()
TestTargetImputation.testImputation()
TestTargetProperty
TestTargetProperty.addClassCleanup()
TestTargetProperty.addCleanup()
TestTargetProperty.addTypeEqualityFunc()
TestTargetProperty.assertAlmostEqual()
TestTargetProperty.assertCountEqual()
TestTargetProperty.assertDictEqual()
TestTargetProperty.assertEqual()
TestTargetProperty.assertFalse()
TestTargetProperty.assertGreater()
TestTargetProperty.assertGreaterEqual()
TestTargetProperty.assertIn()
TestTargetProperty.assertIs()
TestTargetProperty.assertIsInstance()
TestTargetProperty.assertIsNone()
TestTargetProperty.assertIsNot()
TestTargetProperty.assertIsNotNone()
TestTargetProperty.assertLess()
TestTargetProperty.assertLessEqual()
TestTargetProperty.assertListEqual()
TestTargetProperty.assertLogs()
TestTargetProperty.assertMultiLineEqual()
TestTargetProperty.assertNoLogs()
TestTargetProperty.assertNotAlmostEqual()
TestTargetProperty.assertNotEqual()
TestTargetProperty.assertNotIn()
TestTargetProperty.assertNotIsInstance()
TestTargetProperty.assertNotRegex()
TestTargetProperty.assertRaises()
TestTargetProperty.assertRaisesRegex()
TestTargetProperty.assertRegex()
TestTargetProperty.assertSequenceEqual()
TestTargetProperty.assertSetEqual()
TestTargetProperty.assertTrue()
TestTargetProperty.assertTupleEqual()
TestTargetProperty.assertWarns()
TestTargetProperty.assertWarnsRegex()
TestTargetProperty.checkTargetProperty()
TestTargetProperty.countTestCases()
TestTargetProperty.debug()
TestTargetProperty.defaultTestResult()
TestTargetProperty.doClassCleanups()
TestTargetProperty.doCleanups()
TestTargetProperty.enterClassContext()
TestTargetProperty.enterContext()
TestTargetProperty.fail()
TestTargetProperty.failureException
TestTargetProperty.id()
TestTargetProperty.longMessage
TestTargetProperty.maxDiff
TestTargetProperty.run()
TestTargetProperty.setUp()
TestTargetProperty.setUpClass()
TestTargetProperty.shortDescription()
TestTargetProperty.skipTest()
TestTargetProperty.subTest()
TestTargetProperty.tearDown()
TestTargetProperty.tearDownClass()
TestTargetProperty.testInit()
TestTargetProperty.testSerialization
TestTargetProperty.testSerialization_0()
TestTargetProperty.testSerialization_1()
TestTargetTransformation
TestTargetTransformation.addClassCleanup()
TestTargetTransformation.addCleanup()
TestTargetTransformation.addTypeEqualityFunc()
TestTargetTransformation.assertAlmostEqual()
TestTargetTransformation.assertCountEqual()
TestTargetTransformation.assertDictEqual()
TestTargetTransformation.assertEqual()
TestTargetTransformation.assertFalse()
TestTargetTransformation.assertGreater()
TestTargetTransformation.assertGreaterEqual()
TestTargetTransformation.assertIn()
TestTargetTransformation.assertIs()
TestTargetTransformation.assertIsInstance()
TestTargetTransformation.assertIsNone()
TestTargetTransformation.assertIsNot()
TestTargetTransformation.assertIsNotNone()
TestTargetTransformation.assertLess()
TestTargetTransformation.assertLessEqual()
TestTargetTransformation.assertListEqual()
TestTargetTransformation.assertLogs()
TestTargetTransformation.assertMultiLineEqual()
TestTargetTransformation.assertNoLogs()
TestTargetTransformation.assertNotAlmostEqual()
TestTargetTransformation.assertNotEqual()
TestTargetTransformation.assertNotIn()
TestTargetTransformation.assertNotIsInstance()
TestTargetTransformation.assertNotRegex()
TestTargetTransformation.assertRaises()
TestTargetTransformation.assertRaisesRegex()
TestTargetTransformation.assertRegex()
TestTargetTransformation.assertSequenceEqual()
TestTargetTransformation.assertSetEqual()
TestTargetTransformation.assertTrue()
TestTargetTransformation.assertTupleEqual()
TestTargetTransformation.assertWarns()
TestTargetTransformation.assertWarnsRegex()
TestTargetTransformation.clearGenerated()
TestTargetTransformation.countTestCases()
TestTargetTransformation.createLargeMultitaskDataSet()
TestTargetTransformation.createLargeTestDataSet()
TestTargetTransformation.createSmallTestDataSet()
TestTargetTransformation.createTestDataSetFromFrame()
TestTargetTransformation.debug()
TestTargetTransformation.defaultTestResult()
TestTargetTransformation.doClassCleanups()
TestTargetTransformation.doCleanups()
TestTargetTransformation.enterClassContext()
TestTargetTransformation.enterContext()
TestTargetTransformation.fail()
TestTargetTransformation.failureException
TestTargetTransformation.getAllDescriptors()
TestTargetTransformation.getBigDF()
TestTargetTransformation.getDataPrepGrid()
TestTargetTransformation.getDefaultCalculatorCombo()
TestTargetTransformation.getDefaultPrep()
TestTargetTransformation.getPrepCombos()
TestTargetTransformation.getSmallDF()
TestTargetTransformation.id()
TestTargetTransformation.longMessage
TestTargetTransformation.maxDiff
TestTargetTransformation.prop_transform()
TestTargetTransformation.run()
TestTargetTransformation.setUp()
TestTargetTransformation.setUpClass()
TestTargetTransformation.setUpPaths()
TestTargetTransformation.shortDescription()
TestTargetTransformation.skipTest()
TestTargetTransformation.subTest()
TestTargetTransformation.tearDown()
TestTargetTransformation.tearDownClass()
TestTargetTransformation.testTransformation()
TestTargetTransformation.validate_split()
prop_transform()
- Module contents