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VelocityRescalingThermostat Member List
This is the complete list of members for
VelocityRescalingThermostat
, including all inherited members.
calcCurrentTemperature
(const State &state) const
VelocityRescalingThermostat
calcNumThermalDofs
(const State &state) const
VelocityRescalingThermostat
getBathTemperature
() const
VelocityRescalingThermostat
getEventInterval
() const
PeriodicEventHandler
getNextEventTime
(const State &state, bool includeCurrentTime) const
PeriodicEventHandler
[virtual]
getNumExcludedDofs
() const
VelocityRescalingThermostat
handleEvent
(State &state, Real accuracy, const Vector &yWeights, const Vector &ooConstraintTols, Stage &lowestModified, bool &shouldTerminate) const =0
EventHandler
[pure virtual]
PeriodicEventHandler
(Real eventInterval)
PeriodicEventHandler
rescale
(State &state) const
VelocityRescalingThermostat
setBathTemperature
(Real bathTemperature)
VelocityRescalingThermostat
setEventInterval
(Real eventInterval)
PeriodicEventHandler
setNumExcludedDofs
(int numExcludedDofs)
VelocityRescalingThermostat
VelocityRescalingThermostat
(const MolecularMechanicsSystem &system, Real bathTemperature=293.15, Real rescalingInterval=1, int numExcludedDofs=6)
VelocityRescalingThermostat
[explicit]
~EventHandler
()
EventHandler
[virtual]
~PeriodicEventHandler
()
PeriodicEventHandler
~ScheduledEventHandler
()
ScheduledEventHandler
[virtual]
~VelocityRescalingThermostat
()
VelocityRescalingThermostat
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