Merge branch 'release/3.1.0'
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- pom.xml 13 additions, 1 deletionpom.xml
- ssip-core/pom.xml 1 addition, 1 deletionssip-core/pom.xml
- ssip-footprint/pom.xml 1 addition, 1 deletionssip-footprint/pom.xml
- ssip-footprint/src/main/java/uk/ac/cam/ch/hunter/ssip/footprint/Molecule.java 4 additions, 2 deletions...ain/java/uk/ac/cam/ch/hunter/ssip/footprint/Molecule.java
- ssip-footprint/src/main/java/uk/ac/cam/ch/hunter/ssip/footprint/cli/FootPrint.java 2 additions, 1 deletion...ava/uk/ac/cam/ch/hunter/ssip/footprint/cli/FootPrint.java
- ssip-footprint/src/main/java/uk/ac/cam/ch/hunter/ssip/footprint/cli/FootPrintCli.java 4 additions, 4 deletions.../uk/ac/cam/ch/hunter/ssip/footprint/cli/FootPrintCli.java
- ssip-footprint/src/test/java/uk/ac/cam/ch/hunter/ssip/footprint/OriginalSSIPSelectorTest.java 32 additions, 26 deletions...am/ch/hunter/ssip/footprint/OriginalSSIPSelectorTest.java
- ssip-phasetransfer/pom.xml 9 additions, 1 deletionssip-phasetransfer/pom.xml
- ssip-phasetransfer/src/main/java/uk/ac/cam/ch/hunter/ssip/phasetransfer/AssociationConstantsFactory.java 18 additions, 2 deletions...unter/ssip/phasetransfer/AssociationConstantsFactory.java
- ssip-phasetransfer/src/main/java/uk/ac/cam/ch/hunter/ssip/phasetransfer/ConcentrationCalculator.java 1 addition, 1 deletion...ch/hunter/ssip/phasetransfer/ConcentrationCalculator.java
- ssip-phasetransfer/src/main/java/uk/ac/cam/ch/hunter/ssip/phasetransfer/core/temperature/InteractionEnergyCalculator.java 151 additions, 0 deletions...ransfer/core/temperature/InteractionEnergyCalculator.java
- ssip-phasetransfer/src/test/java/uk/ac/cam/ch/hunter/ssip/phasetransfer/ConcentrationCalculatorTest.java 19 additions, 19 deletions...unter/ssip/phasetransfer/ConcentrationCalculatorTest.java
- ssip-phasetransfer/src/test/java/uk/ac/cam/ch/hunter/ssip/phasetransfer/core/MixtureTest.java 21 additions, 21 deletions...ac/cam/ch/hunter/ssip/phasetransfer/core/MixtureTest.java
- ssip-phasetransfer/src/test/java/uk/ac/cam/ch/hunter/ssip/phasetransfer/core/PhaseTest.java 22 additions, 22 deletions...k/ac/cam/ch/hunter/ssip/phasetransfer/core/PhaseTest.java
- ssip-phasetransfer/src/test/java/uk/ac/cam/ch/hunter/ssip/phasetransfer/core/temperature/InteractionEnergyCalculatorTest.java 94 additions, 0 deletions...fer/core/temperature/InteractionEnergyCalculatorTest.java
- ssip-phasetransfer/src/test/resources/uk/ac/cam/ch/hunter/ssip/phasetransfer/WaterPhase.xml 28 additions, 28 deletions...ces/uk/ac/cam/ch/hunter/ssip/phasetransfer/WaterPhase.xml
- ssip-phasetransfer/src/test/resources/uk/ac/cam/ch/hunter/ssip/phasetransfer/expectedPhaseCollection.xml 28 additions, 28 deletions.../ch/hunter/ssip/phasetransfer/expectedPhaseCollection.xml
- ssip-phasetransfer/src/test/resources/uk/ac/cam/ch/hunter/ssip/phasetransfer/expectedPhaseCollectionList.xml 28 additions, 28 deletions...hunter/ssip/phasetransfer/expectedPhaseCollectionList.xml
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