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DENOPTIM
Public Member Functions | Private Member Functions | Private Attributes | List of all members
denoptim.utils.MoleculeUtilsTest Class Reference

Unit test for DENOPTIMMoleculeUtils. More...

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Public Member Functions

void testGetPoint3d () throws Exception
 
void testCalculateCentroid () throws Exception
 

Private Member Functions

boolean areCloseEnough (double a, double b)
 

Private Attributes

IChemObjectBuilder builder = SilentChemObjectBuilder.getInstance()
 

Detailed Description

Unit test for DENOPTIMMoleculeUtils.

Author
Marco Foscato

Definition at line 41 of file MoleculeUtilsTest.java.

Member Function Documentation

◆ areCloseEnough()

boolean denoptim.utils.MoleculeUtilsTest.areCloseEnough ( double  a,
double  b 
)
private

Definition at line 70 of file MoleculeUtilsTest.java.

Referenced by denoptim.utils.MoleculeUtilsTest.testCalculateCentroid(), and denoptim.utils.MoleculeUtilsTest.testGetPoint3d().

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◆ testCalculateCentroid()

void denoptim.utils.MoleculeUtilsTest.testCalculateCentroid ( ) throws Exception

Definition at line 79 of file MoleculeUtilsTest.java.

References denoptim.utils.MoleculeUtilsTest.areCloseEnough(), denoptim.utils.MoleculeUtilsTest.builder, and denoptim.utils.MoleculeUtils.calculateCentroid().

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◆ testGetPoint3d()

void denoptim.utils.MoleculeUtilsTest.testGetPoint3d ( ) throws Exception

Definition at line 48 of file MoleculeUtilsTest.java.

References denoptim.utils.MoleculeUtilsTest.areCloseEnough().

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Member Data Documentation

◆ builder

IChemObjectBuilder denoptim.utils.MoleculeUtilsTest.builder = SilentChemObjectBuilder.getInstance()
private

Definition at line 43 of file MoleculeUtilsTest.java.

Referenced by denoptim.utils.MoleculeUtilsTest.testCalculateCentroid().

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