denoptim.fragmenter.DynamicCentroidClusterTest Class Reference

Unit test for fragmenter's tools. More...

Collaboration diagram for denoptim.fragmenter.DynamicCentroidClusterTest:

Public Member Functions
void	testGetCentroid () throws Exception
void	testGetNearestToCentroid () throws Exception

Private Attributes
IChemObjectBuilder	builder = SilentChemObjectBuilder.getInstance()
	Private builder of atom containers. More...

Detailed Description

Unit test for fragmenter's tools.

Definition at line 25 of file DynamicCentroidClusterTest.java.

Member Function Documentation

testGetCentroid()

void denoptim.fragmenter.DynamicCentroidClusterTest.testGetCentroid

(

)

throws Exception

Definition at line 36 of file DynamicCentroidClusterTest.java.

References denoptim.graph.Fragment.addAP(), denoptim.fragmenter.DynamicCentroidCluster.addPoint(), denoptim.fragmenter.DynamicCentroidClusterTest.builder, denoptim.fragmenter.FragmentClusterer.DistanceAsRMSD.compute(), denoptim.fragmenter.DynamicCentroidCluster.getCentroid(), denoptim.fragmenter.ClusterableFragment.getPoint(), denoptim.graph.APClass.make(), denoptim.fragmenter.ClusterableFragment.setNaturalNodeOrder(), and denoptim.graph.Vertex.BBType.UNDEFINED.

Here is the call graph for this function:

testGetNearestToCentroid()

void denoptim.fragmenter.DynamicCentroidClusterTest.testGetNearestToCentroid

(

)

throws Exception

Definition at line 85 of file DynamicCentroidClusterTest.java.

References denoptim.graph.Fragment.addAP(), denoptim.fragmenter.DynamicCentroidCluster.addPoint(), denoptim.fragmenter.DynamicCentroidClusterTest.builder, denoptim.fragmenter.FragmentClusterer.DistanceAsRMSD.compute(), denoptim.fragmenter.DynamicCentroidCluster.getNearestToCentroid(), denoptim.fragmenter.ClusterableFragment.getPoint(), denoptim.graph.APClass.make(), denoptim.fragmenter.ClusterableFragment.setNaturalNodeOrder(), and denoptim.graph.Vertex.BBType.UNDEFINED.

Here is the call graph for this function:

Member Data Documentation

builder

IChemObjectBuilder denoptim.fragmenter.DynamicCentroidClusterTest.builder = SilentChemObjectBuilder.getInstance()

private

Private builder of atom containers.

Definition at line 31 of file DynamicCentroidClusterTest.java.

Referenced by denoptim.fragmenter.DynamicCentroidClusterTest.testGetCentroid(), and denoptim.fragmenter.DynamicCentroidClusterTest.testGetNearestToCentroid().

---

The documentation for this class was generated from the following file:

• /github/workspace/src/test/java/denoptim/fragmenter/DynamicCentroidClusterTest.java