NAMD
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#include <ReductionMgr.h>
Public Member Functions | |
BigReal | item (int i) const |
virtual void | require (const bool clearData=true)=0 |
virtual | ~RequireReduction () |
Protected Attributes | |
BigReal * | data |
Definition at line 400 of file ReductionMgr.h.
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inlinevirtual |
Definition at line 407 of file ReductionMgr.h.
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inline |
Definition at line 404 of file ReductionMgr.h.
References data.
Referenced by Controller::compareChecksums(), Controller::correctMomentum(), PressureProfileReduction::getData(), Controller::getTotalPotentialEnergy(), Controller::minimize(), Controller::multigratorPressure(), Controller::multigratorTemperature(), Controller::printEnergies(), Controller::printMinimizeEnergies(), Controller::receivePressure(), and Controller::rescaleaccelMD().
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pure virtual |
Implemented in RequireReductionShared, and RequireReductionCharm.
Referenced by PressureProfileReduction::getData(), Controller::minimize(), Controller::monteCarloPressure_accept(), Controller::monteCarloPressure_prepare(), Controller::multigratorPressure(), Controller::multigratorTemperature(), Controller::receivePressure(), and Controller::rescaleaccelMD().
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protected |
Definition at line 402 of file ReductionMgr.h.
Referenced by item(), and RequireReductionShared::RequireReductionShared().