Index

B

bondClassifierNames (C++ function) bulkRingNumberAnalysis (C++ function)

bulkTopologicalNetworkCriterion (C++ function) bulkTopoUnitMatching (C++ function)

C

cageAffiliation (C++ function) calcRDF (C++ function)

classifyBonds (C++ function) classifyTemplates (C++ function) clusterAnalysis (C++ function)

G

getCorrel (C++ function) getCorrelPlus (C++ function) getHbondNetwork (C++ function) getHbondNetworkFromClouds (C++ function) getIceType (C++ function)

getIceTypeNoPrint (C++ function) getIceTypePlus (C++ function) getIceTypePlusNoPrint (C++ function) getNewNeighbourListByIndex (C++ function) getPointCloudAtomsOfOneAtomType (C++ function)

K

kNearestNeighbourList (C++ function)

N

neighbourListByIndex (C++ function)

neighListO (C++ function)

P

prismAnalysis (C++ function)

R

readChemfiles (C++ function) readCon (C++ function) readLammpsTrjO (C++ function) readLammpsTrjreduced (C++ function) readXYZ (C++ function) recenterCluster (C++ function) registerAll (C++ function) registerBondClassifier (C++ function)

registerDescriptors (C++ function) registerIO (C++ function) registerNeighbours (C++ function) registerOrder (C++ function) registerRings (C++ function) registerTopology (C++ function) ringAnalysis (C++ function) ringNetwork (C++ function)

S

seededCageAffiliation (C++ function) selectAtomsInSliceWithRingEdgeAtoms (C++ function) selectEdgeAtomsInRingsWithinSlice (C++ function) selectInSingleSlice (C++ function)

shellSeparation (C++ function) soapSpectrum (C++ function) soapSpectrumAll (C++ function) steinhardtQl (C++ function) steinhardtQlVoronoi (C++ function)

V

voronoiFacetWeights (C++ function)

voronoiFeatures (C++ function)

W

writeDump (C++ function)

writeHistogram (C++ function)