@TestClass(value="org.openscience.cdk.tools.AtomicPropertiesTest") public class AtomicProperties extends Object
Modifier and Type | Method and Description |
---|---|
double |
getElectronegativity(String symbol) |
static AtomicProperties |
getInstance() |
double |
getMass(String symbol) |
double |
getNormalizedElectronegativity(String symbol) |
double |
getNormalizedMass(String symbol) |
double |
getNormalizedPolarizability(String symbol) |
double |
getNormalizedVdWVolume(String symbol) |
double |
getPolarizability(String symbol) |
double |
getVdWVolume(String symbol) |
@TestMethod(value="testGetVdWVolume") public double getVdWVolume(String symbol)
@TestMethod(value="testGetNormalizedVdWVolume") public double getNormalizedVdWVolume(String symbol)
@TestMethod(value="testGetElectronegativity") public double getElectronegativity(String symbol)
@TestMethod(value="testGetNormalizedElectronegativity") public double getNormalizedElectronegativity(String symbol)
@TestMethod(value="testGetPolarizability") public double getPolarizability(String symbol)
@TestMethod(value="testGetNormalizedPolarizability") public double getNormalizedPolarizability(String symbol)
@TestMethod(value="testGetMass") public double getMass(String symbol)
@TestMethod(value="testGetNormalizedMass") public double getNormalizedMass(String symbol)
@TestMethod(value="testGetInstance") public static AtomicProperties getInstance() throws IOException
IOException