allowRingClosures(boolean value) | denoptim.graph.rings.RingClosureParameters | |
allowRingClosures() | denoptim.graph.rings.RingClosureParameters | |
buildChelatesMode | denoptim.graph.rings.RingClosureParameters | protected |
buildChelatesMode() | denoptim.graph.rings.RingClosureParameters | |
checkInterdependentChains() | denoptim.graph.rings.RingClosureParameters | |
checkInterdepPaths | denoptim.graph.rings.RingClosureParameters | protected |
checkOtherParameters() | denoptim.programs.RunTimeParameters | protected |
checkParameters() | denoptim.graph.rings.RingClosureParameters | |
closeRings | denoptim.graph.rings.RingClosureParameters | protected |
containsParameters(ParametersType type) | denoptim.programs.RunTimeParameters | |
doExhaustiveConfSrch() | denoptim.graph.rings.RingClosureParameters | |
ensureFileExists(String pathname) | denoptim.programs.RunTimeParameters | protected |
ensureFileExistsIfSet(String pathname) | denoptim.programs.RunTimeParameters | protected |
ensureInRange(String paramName, int value, int min, int max, String paramKey) | denoptim.programs.RunTimeParameters | protected |
ensureIsPositive(String paramName, int value, String paramKey) | denoptim.programs.RunTimeParameters | protected |
ensureIsPositiveOrZero(String paramName, int value, String paramKey) | denoptim.programs.RunTimeParameters | protected |
ensureNotNull(String paramName, String param, String paramKey) | denoptim.programs.RunTimeParameters | protected |
exhaustiveConfSrch | denoptim.graph.rings.RingClosureParameters | protected |
getClosabilityEvalMode() | denoptim.graph.rings.RingClosureParameters | |
getConfPathExtraTolerance() | denoptim.graph.rings.RingClosureParameters | |
getConstitutionalClosabilityConds() | denoptim.graph.rings.RingClosureParameters | |
getInstanceFor(ParametersType paramType) | denoptim.programs.RunTimeParameters | privatestatic |
getLinearityLimit() | denoptim.graph.rings.RingClosureParameters | |
getLogFilePathname() | denoptim.programs.RunTimeParameters | |
getLogger() | denoptim.programs.RunTimeParameters | |
getMaxNumberRotatableBonds() | denoptim.graph.rings.RingClosureParameters | |
getMaxRcaPerType(String type) | denoptim.graph.rings.RingClosureParameters | |
getMaxRingClosures() | denoptim.graph.rings.RingClosureParameters | |
getMaxRingSize() | denoptim.graph.rings.RingClosureParameters | |
getMinRcaPerType(String type) | denoptim.graph.rings.RingClosureParameters | |
getMinRingClosures() | denoptim.graph.rings.RingClosureParameters | |
getParameters(ParametersType type) | denoptim.programs.RunTimeParameters | |
getPathConfSearchStep() | denoptim.graph.rings.RingClosureParameters | |
getPrintedList() | denoptim.graph.rings.RingClosureParameters | |
getRandomizer() | denoptim.programs.RunTimeParameters | |
getRandomSeed() | denoptim.programs.RunTimeParameters | |
getRCCLibraryFolder() | denoptim.graph.rings.RingClosureParameters | |
getRCCLibraryIndexFile() | denoptim.graph.rings.RingClosureParameters | |
getRCDistTolerance() | denoptim.graph.rings.RingClosureParameters | |
getRCDotPrTolerance() | denoptim.graph.rings.RingClosureParameters | |
getRequiredRingElements() | denoptim.graph.rings.RingClosureParameters | |
getRingClosuresArchive() | denoptim.graph.rings.RingClosureParameters | |
getRingSizeBias() | denoptim.graph.rings.RingClosureParameters | |
getVerbosity() | denoptim.graph.rings.RingClosureParameters | |
getWorkDirectory() | denoptim.programs.RunTimeParameters | |
interpretKeyword(String key, String value) | denoptim.graph.rings.RingClosureParameters | |
denoptim::programs::RunTimeParameters.interpretKeyword(String line) | denoptim.programs.RunTimeParameters | |
isMaster | denoptim.programs.RunTimeParameters | protected |
linearityLimit | denoptim.graph.rings.RingClosureParameters | protected |
logFile | denoptim.programs.RunTimeParameters | protected |
logger | denoptim.programs.RunTimeParameters | private |
maxRcaPerType | denoptim.graph.rings.RingClosureParameters | protected |
maxRingClosures | denoptim.graph.rings.RingClosureParameters | protected |
maxRingSize | denoptim.graph.rings.RingClosureParameters | protected |
maxRotBonds | denoptim.graph.rings.RingClosureParameters | protected |
metalCoordinatingAPClasses | denoptim.graph.rings.RingClosureParameters | protected |
minRcaPerType | denoptim.graph.rings.RingClosureParameters | protected |
minRingClosures | denoptim.graph.rings.RingClosureParameters | protected |
NL | denoptim.programs.RunTimeParameters | |
otherParameters | denoptim.programs.RunTimeParameters | protected |
paramType | denoptim.programs.RunTimeParameters | private |
paramTypeName() | denoptim.programs.RunTimeParameters | |
pathConfSearchExtraTol | denoptim.graph.rings.RingClosureParameters | protected |
pathConfSearchStep | denoptim.graph.rings.RingClosureParameters | protected |
printParameters() | denoptim.programs.RunTimeParameters | |
processOtherParameters() | denoptim.programs.RunTimeParameters | protected |
processParameters() | denoptim.graph.rings.RingClosureParameters | |
rcArchive | denoptim.graph.rings.RingClosureParameters | private |
rccFolder | denoptim.graph.rings.RingClosureParameters | protected |
rccIndex | denoptim.graph.rings.RingClosureParameters | protected |
rceMode | denoptim.graph.rings.RingClosureParameters | protected |
rcMaxDot | denoptim.graph.rings.RingClosureParameters | protected |
rcTolDist | denoptim.graph.rings.RingClosureParameters | protected |
readParameterFile(String infile) | denoptim.programs.RunTimeParameters | |
readParameterLine(String line) | denoptim.programs.RunTimeParameters | |
readYesNoTrueFalse(String s) | denoptim.programs.RunTimeParameters | static |
reqElInRings | denoptim.graph.rings.RingClosureParameters | protected |
requireCompleteRingclosure | denoptim.graph.rings.RingClosureParameters | |
ringClosabCondAsSMARTS | denoptim.graph.rings.RingClosureParameters | protected |
RingClosureParameters() | denoptim.graph.rings.RingClosureParameters | |
ringSizeBias | denoptim.graph.rings.RingClosureParameters | protected |
rng | denoptim.programs.RunTimeParameters | private |
RunTimeParameters(ParametersType paramType) | denoptim.programs.RunTimeParameters | |
selectFragmentsFromClosableChains() | denoptim.graph.rings.RingClosureParameters | |
selectFragsFromCC | denoptim.graph.rings.RingClosureParameters | protected |
serializeRCCs | denoptim.graph.rings.RingClosureParameters | protected |
serializeRCCs() | denoptim.graph.rings.RingClosureParameters | |
setConstitutionalClosabilityConds(Map< String, String > ringClosabCondAsSMARTS) | denoptim.graph.rings.RingClosureParameters | |
setLogFilePathname(String pathname) | denoptim.programs.RunTimeParameters | |
setLogger(Logger logger) | denoptim.programs.RunTimeParameters | private |
setParameters(RunTimeParameters otherParams) | denoptim.programs.RunTimeParameters | |
setRandomizer(Randomizer rng) | denoptim.programs.RunTimeParameters | |
setRingSizeBias(List< Integer > biases) | denoptim.graph.rings.RingClosureParameters | |
setVerbosity(int l) | denoptim.programs.RunTimeParameters | |
setWorkDirectory(String pathname) | denoptim.programs.RunTimeParameters | |
startConsoleLogger(String loggerIdentifier) | denoptim.programs.RunTimeParameters | |
startProgramSpecificLogger(String loggerIdentifier) | denoptim.programs.RunTimeParameters | |
startProgramSpecificLogger(String loggerIdentifier, boolean toLogFile) | denoptim.programs.RunTimeParameters | |
startRandomizer() | denoptim.programs.RunTimeParameters | |
startRandomizer(long seed) | denoptim.programs.RunTimeParameters | |
verbosity | denoptim.programs.RunTimeParameters | protected |
verbosityTologLevel() | denoptim.programs.RunTimeParameters | private |
workDir | denoptim.programs.RunTimeParameters | protected |