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NAMD
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#include <ComputeBonds.h>
Public Member Functions | |
| ComputeSelfBonds (ComputeID c, PatchID p) | |
Public Member Functions inherited from ComputeSelfTuples< BondElem, Bond, BondValue > | |
| ComputeSelfTuples (ComputeID c, PatchID p) | |
| virtual | ~ComputeSelfTuples () |
| virtual void | initialize (void) |
| void | doWork (void) |
Public Member Functions inherited from ComputeHomeTuples< BondElem, Bond, BondValue > | |
| virtual | ~ComputeHomeTuples () |
| void | atomUpdate (void) |
Public Member Functions inherited from Compute | |
| Compute (ComputeID) | |
| int | type () |
| virtual | ~Compute () |
| void | setNumPatches (int n) |
| int | getNumPatches () |
| virtual void | patchReady (PatchID, int doneMigration, int seq) |
| virtual int | noWork () |
| virtual void | finishPatch (int) |
| int | sequence (void) |
| int | priority (void) |
| int | getGBISPhase (void) |
| virtual void | gbisP2PatchReady (PatchID, int seq) |
| virtual void | gbisP3PatchReady (PatchID, int seq) |
Additional Inherited Members | |
Public Attributes inherited from Compute | |
| const ComputeID | cid |
| LDObjHandle | ldObjHandle |
| LocalWorkMsg *const | localWorkMsg |
Protected Member Functions inherited from ComputeHomeTuples< BondElem, Bond, BondValue > | |
| ComputeHomeTuples (ComputeID c) | |
| ComputeHomeTuples (ComputeID c, PatchIDList &pids) | |
Protected Member Functions inherited from Compute | |
| void | enqueueWork () |
Protected Attributes inherited from ComputeHomeTuples< BondElem, Bond, BondValue > | |
| int | doLoadTuples |
| ResizeArray< BondElem > | tupleList |
| TuplePatchList | tuplePatchList |
| PatchMap * | patchMap |
| AtomMap * | atomMap |
| SubmitReduction * | reduction |
| int | accelMDdoDihe |
| SubmitReduction * | pressureProfileReduction |
| BigReal * | pressureProfileData |
| int | pressureProfileSlabs |
| char * | isBasePatch |
Protected Attributes inherited from Compute | |
| int | computeType |
| int | basePriority |
| int | gbisPhase |
| int | gbisPhasePriority [3] |
Definition at line 71 of file ComputeBonds.h.
Definition at line 75 of file ComputeBonds.h.
1.8.14