denoptim.integration.tinker.TinkerUtilsTest Class Reference

Unit test for TinkerUtils. More...

Collaboration diagram for denoptim.integration.tinker.TinkerUtilsTest:

Public Member Functions
void	testINTRoundTrip () throws Exception
void	testWriteTinkerINT () throws Exception

Package Attributes
Path	tempDir

Detailed Description

Unit test for TinkerUtils.

Author

Marco Foscato

Definition at line 42 of file TinkerUtilsTest.java.

Member Function Documentation

testINTRoundTrip()

void denoptim.integration.tinker.TinkerUtilsTest.testINTRoundTrip

(

)

throws Exception

Definition at line 50 of file TinkerUtilsTest.java.

References denoptim.molecularmodeling.zmatrix.ZMatrix.addAtom(), denoptim.molecularmodeling.zmatrix.ZMatrix.addBond(), denoptim.molecularmodeling.zmatrix.ZMatrix.equals(), denoptim.integration.tinker.TinkerUtils.readTinkerINT(), denoptim.molecularmodeling.zmatrix.ZMatrix.setId(), denoptim.integration.tinker.TinkerUtilsTest.tempDir, and denoptim.integration.tinker.TinkerUtils.writeTinkerINT().

Here is the call graph for this function:

testWriteTinkerINT()

void denoptim.integration.tinker.TinkerUtilsTest.testWriteTinkerINT

(

)

throws Exception

Definition at line 107 of file TinkerUtilsTest.java.

References denoptim.molecularmodeling.zmatrix.ZMatrix.addAtom(), denoptim.molecularmodeling.zmatrix.ZMatrix.addBond(), denoptim.molecularmodeling.zmatrix.ZMatrix.setId(), denoptim.integration.tinker.TinkerUtilsTest.tempDir, and denoptim.integration.tinker.TinkerUtils.writeTinkerINT().

Here is the call graph for this function:

Member Data Documentation

tempDir

Path denoptim.integration.tinker.TinkerUtilsTest.tempDir

package

Definition at line 45 of file TinkerUtilsTest.java.

Referenced by denoptim.integration.tinker.TinkerUtilsTest.testINTRoundTrip(), and denoptim.integration.tinker.TinkerUtilsTest.testWriteTinkerINT().

---

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

• /github/workspace/src/test/java/denoptim/integration/tinker/TinkerUtilsTest.java