All Classes Namespaces Files Functions Variables Typedefs Enumerations Enumerator Friends Macros Groups Pages
PLMD::manyrestraints::UWalls Member List

This is the complete list of members for PLMD::manyrestraints::UWalls, including all inherited members.

accumulateDerivative(const unsigned &ider, const double &df)PLMD::vesselbase::ActionWithVesselinlineprotected
Action(const ActionOptions &)PLMD::Action
ActionPilot(const ActionOptions &)PLMD::ActionPilot
ActionWithInputVessel(const ActionOptions &)PLMD::vesselbase::ActionWithInputVessel
ActionWithValue(const ActionOptions &ao)PLMD::ActionWithValue
ActionWithVessel(const ActionOptions &ao)PLMD::vesselbase::ActionWithVessel
activate()PLMD::Actionvirtual
activateIndexes(const unsigned &, const unsigned &, const std::vector< unsigned > &)PLMD::vesselbase::ActionWithVesselinlinevirtual
activateTheseTasks(std::vector< bool > &addtionalTasks)PLMD::vesselbase::ActionWithVessel
addBridgeForces(const std::vector< double > &bb)PLMD::vesselbase::ActionWithInputVesselinlinevirtual
addBridgingVessel(ActionWithVessel *tome)PLMD::vesselbase::ActionWithVesselprotected
addComponent(const std::string &name)PLMD::ActionWithValue
addComponentWithDerivatives(const std::string &name)PLMD::ActionWithValue
addDependency(Action *)PLMD::Action
addElementDerivative(const unsigned &, const double &)PLMD::vesselbase::ActionWithVesselinline
addElementValue(const unsigned &, const double &)PLMD::vesselbase::ActionWithVesselinline
addForcesOnArguments(const std::vector< double > &forces)PLMD::vesselbase::ActionWithInputVesselprotected
addTaskToList(const unsigned &taskCode)PLMD::vesselbase::ActionWithVesselprotected
addValue()PLMD::ActionWithValue
addValueWithDerivatives()PLMD::ActionWithValue
addVessel(const std::string &name, const std::string &input, const int numlab=0)PLMD::vesselbase::ActionWithVesselprotected
addVessel(Vessel *vv)PLMD::vesselbase::ActionWithVesselprotected
apply()PLMD::manyrestraints::ManyRestraintsBasevirtual
applyBridgeForces(const std::vector< double > &bb)PLMD::manyrestraints::ManyRestraintsBaseinlinevirtual
applyChainRuleForDerivatives(const double &df)PLMD::manyrestraints::ManyRestraintsBaseprotected
atPLMD::manyrestraints::UWallsprivate
bridgeVariablePLMD::vesselbase::ActionWithVesselprotected
buildDataStashes()PLMD::vesselbase::ActionWithVesselvirtual
calculate()PLMD::manyrestraints::ManyRestraintsBaseinlinevirtual
calculateAllVessels()PLMD::vesselbase::ActionWithVesselprotected
calculateFromPDB(const PDB &)PLMD::Action
PLMD::calculateNumericalDerivatives(ActionWithValue *a=NULL)PLMD::Actionvirtual
PLMD::vesselbase::ActionWithInputVessel::calculateNumericalDerivatives(ActionWithValue *a=NULL)PLMD::vesselbase::ActionWithInputVesselvirtual
chainRuleForElementDerivatives(const unsigned &, const unsigned &, const double &, Vessel *)PLMD::vesselbase::ActionWithVessel
chainRuleForElementDerivatives(const unsigned &, const unsigned &, const unsigned &, const unsigned &, const double &, Vessel *)PLMD::vesselbase::ActionWithVessel
checkFieldsAllowed()PLMD::ActionWithValueinlinevirtual
checkNeedsGradients() const PLMD::Actioninlinevirtual
checkNumericalDerivatives() const PLMD::ActionWithValueinlinevirtual
checkRead()PLMD::Action
cite(const std::string &s)PLMD::Action
clearAfterTask()PLMD::vesselbase::ActionWithVesselprotected
clearDependencies()PLMD::Action
clearDerivatives()PLMD::manyrestraints::ManyRestraintsBaseinlinevirtual
clearDerivativesAfterTask(const unsigned &)PLMD::vesselbase::ActionWithVesselvirtual
clearInputForces()PLMD::ActionWithValue
clearOptions()PLMD::Actionvirtual
commPLMD::Action
componentIsNotPeriodic(const std::string &name)PLMD::ActionWithValue
componentIsPeriodic(const std::string &name, const std::string &min, const std::string &max)PLMD::ActionWithValue
componentsAreNotOptional(Keywords &keys)PLMD::ActionWithValuestatic
contributorsAreUnlockedPLMD::vesselbase::ActionWithVesselprotected
copyOutput(const std::string &name) const PLMD::ActionWithValue
copyOutput(const unsigned &n) const PLMD::ActionWithValue
deactivate()PLMD::Actioninlinevirtual
deactivate_task()PLMD::manyrestraints::ManyRestraintsBaseinlinevirtual
deactivateAllTasks()PLMD::vesselbase::ActionWithVesselprotected
deactivateTasksInRange(const unsigned &lower, const unsigned &upper)PLMD::vesselbase::ActionWithVesselprotected
Dependencies typedefPLMD::Action
derivativesAreRequired() const PLMD::vesselbase::ActionWithVesselinline
doJobsRequiredBeforeTaskList()PLMD::manyrestraints::ManyRestraintsBasevirtual
doNotCalculateDerivatives() const PLMD::ActionWithValueinline
epsPLMD::manyrestraints::UWallsprivate
error(const std::string &msg) const PLMD::Action
exists(const std::string &name) const PLMD::ActionWithValue
exit(int c=0)PLMD::Action
expPLMD::manyrestraints::UWallsprivate
fclose(FILE *fp)PLMD::Action
fflush()PLMD::Action
filesPLMD::Action
files_iterator typedefPLMD::Action
finishComputations()PLMD::vesselbase::ActionWithVesselvirtual
finishTaskListUpdate()PLMD::vesselbase::ActionWithVesselinlinevirtual
fopen(const char *path, const char *mode)PLMD::Action
getActiveTask(const unsigned &ii) const PLMD::vesselbase::ActionWithVesselinlineprotected
getComponentsList() const PLMD::ActionWithValue
getComponentsVector() const PLMD::ActionWithValue
getCurrentNumberOfActiveTasks() const PLMD::vesselbase::ActionWithVesselinlineprotected
getCurrentPositionInTaskList() const PLMD::vesselbase::ActionWithVesselinlineprotected
getCurrentTask() const PLMD::vesselbase::ActionWithVesselinlineprotected
getDependencies() const PLMD::Actioninline
getDocumentation() const PLMD::Actionvirtual
getElementDerivative(const unsigned &) const PLMD::vesselbase::ActionWithVesselinline
getElementValue(const unsigned &ival) const PLMD::vesselbase::ActionWithVesselinline
getExchangeStep() const PLMD::Action
getForcesFromVessels(std::vector< double > &forcesToApply)PLMD::vesselbase::ActionWithVesselprotected
getFullNumberOfTasks() const PLMD::vesselbase::ActionWithVesselinline
getIndexList(const unsigned &ntotal, const unsigned &jstore, const unsigned &maxder, std::vector< unsigned > &indices)PLMD::vesselbase::ActionWithVesselvirtual
getLabel() const PLMD::Actioninline
getName() const PLMD::Actioninline
getNLTolerance() const PLMD::vesselbase::ActionWithVesselinlineprotected
getNumberOfComponents() const PLMD::ActionWithValueinline
getNumberOfDerivatives()PLMD::manyrestraints::ManyRestraintsBaseinlinevirtual
getNumberOfQuantities()PLMD::vesselbase::ActionWithVesselinlinevirtual
getNumberOfVessels() const PLMD::vesselbase::ActionWithVesselinlineprotected
getOutputQuantity(const unsigned j) const PLMD::ActionWithValueinline
getOutputQuantity(const std::string &name) const PLMD::ActionWithValueinline
getPntrToArgument()PLMD::vesselbase::ActionWithInputVesselinlineprotected
getPntrToComponent(int i)PLMD::ActionWithValueprotected
getPntrToComponent(const std::string &name)PLMD::ActionWithValueprotected
getPntrToValue()PLMD::ActionWithValueprotected
getPntrToVessel(const unsigned &i)PLMD::vesselbase::ActionWithVesselinlineprotected
getPositionInFullTaskList(const unsigned &ii) const PLMD::vesselbase::ActionWithVesselinlineprotected
getStep() const PLMD::Action
getStride() const PLMD::ActionPilotprotected
getTime() const PLMD::Action
getTimeStep() const PLMD::Action
getTolerance() const PLMD::vesselbase::ActionWithVesselinlineprotected
getValue()PLMD::manyrestraints::ManyRestraintsBaseinlineprotected
getVesselWithName(const std::string &mynam)PLMD::vesselbase::ActionWithVessel
getWeight()PLMD::manyrestraints::ManyRestraintsBaseinlineprotected
isActive() const PLMD::Actioninline
isOptionOn(const std::string &s) const PLMD::Actioninline
isPeriodic()PLMD::manyrestraints::ManyRestraintsBaseinlinevirtual
kappaPLMD::manyrestraints::UWallsprivate
keywordsPLMD::Action
lockContributors()PLMD::vesselbase::ActionWithVessel
lockRequests()PLMD::Actioninlinevirtual
logPLMD::Action
ManyRestraintsBase(const ActionOptions &)PLMD::manyrestraints::ManyRestraintsBase
mergeDerivatives(const unsigned &ider, const double &df)PLMD::vesselbase::ActionWithVesselvirtual
multi_sim_commPLMD::Action
needsDerivatives()PLMD::vesselbase::ActionWithVesselprotected
noAnalyticalDerivatives(Keywords &keys)PLMD::ActionWithValuestatic
offsetPLMD::manyrestraints::UWallsprivate
onStep() const PLMD::ActionPilot
parse(const std::string &key, T &t)PLMD::Action
parseFlag(const std::string &key, bool &t)PLMD::Action
parseNumbered(const std::string &key, const int no, T &t)PLMD::Action
parseNumberedVector(const std::string &key, const int no, std::vector< T > &t)PLMD::Action
parseVector(const std::string &key, std::vector< T > &t)PLMD::Action
performTask()PLMD::manyrestraints::UWallsvirtual
plumedPLMD::Action
prepare()PLMD::Actionvirtual
readArgument(const std::string &type)PLMD::vesselbase::ActionWithInputVesselprotected
readAtomsFromPDB(const PDB &)PLMD::Actioninlinevirtual
readVesselKeywords()PLMD::vesselbase::ActionWithVesselprotected
registerKeywords(Keywords &keys)PLMD::manyrestraints::UWallsstatic
resizeFunctions()PLMD::vesselbase::ActionWithVesselprotected
retrieveDomain(std::string &min, std::string &max)PLMD::vesselbase::ActionWithVesselvirtual
runAllTasks()PLMD::vesselbase::ActionWithVesselprotected
runFinalJobs()PLMD::Actioninlinevirtual
serialCalculation() const PLMD::vesselbase::ActionWithVesselinlineprotected
setElementDerivative(const unsigned &, const double &)PLMD::vesselbase::ActionWithVesselinline
setElementValue(const unsigned &, const double &)PLMD::vesselbase::ActionWithVesselinline
setGradientsIfNeeded()PLMD::ActionWithValue
setLowMemOption(const bool &)PLMD::vesselbase::ActionWithVesselinlineprotected
setMaximumNumberOfDerivatives(const unsigned &)PLMD::vesselbase::ActionWithVesselprotected
setNotPeriodic()PLMD::ActionWithValue
setOption(const std::string &s)PLMD::Actionvirtual
setPeriodic(const std::string &min, const std::string &max)PLMD::ActionWithValue
setValue(const double &d)PLMD::ActionWithValueinlineprotected
setValue(Value *, double)PLMD::ActionWithValue
thisval_wassetPLMD::vesselbase::ActionWithVesselprotected
turnOnDerivatives()PLMD::ActionWithValuevirtual
unlockContributors()PLMD::vesselbase::ActionWithVessel
unlockRequests()PLMD::Actioninlinevirtual
update()PLMD::Actioninlinevirtual
useCustomisableComponents(Keywords &keys)PLMD::ActionWithValuestatic
useNumericalDerivatives()PLMD::ActionWithValueinline
usingLowMem() const PLMD::vesselbase::ActionWithVesselinlineprotected
UWalls(const ActionOptions &)PLMD::manyrestraints::UWalls
warning(const std::string &msg)PLMD::Action
weightHasDerivativesPLMD::vesselbase::ActionWithVesselprotected
~Action()PLMD::Actionvirtual
~ActionWithInputVessel()PLMD::vesselbase::ActionWithInputVesselinlinevirtual
~ActionWithValue()PLMD::ActionWithValue
~ActionWithVessel()PLMD::vesselbase::ActionWithVessel