NAMD
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Public Attributes | |
int | sourceNode |
int | numAtoms |
int | timestep |
int | numPCIndxs |
int | pcSelMode |
ComputeQMAtom * | coord |
int * | pcIndxs |
Definition at line 104 of file ComputeQM.C.
ComputeQMAtom* QMCoordMsg::coord |
Definition at line 111 of file ComputeQM.C.
Referenced by ComputeQM::doWork(), ComputeQM::processFullQM(), ComputeQMMgr::procQMRes(), and ComputeQMMgr::recvPartQM().
int QMCoordMsg::numAtoms |
Definition at line 107 of file ComputeQM.C.
Referenced by ComputeQM::doWork(), ComputeQM::processFullQM(), ComputeQMMgr::procQMRes(), and ComputeQMMgr::recvPartQM().
int QMCoordMsg::numPCIndxs |
Definition at line 109 of file ComputeQM.C.
Referenced by ComputeQM::processFullQM(), and ComputeQMMgr::recvPartQM().
int* QMCoordMsg::pcIndxs |
Definition at line 112 of file ComputeQM.C.
Referenced by ComputeQM::processFullQM(), and ComputeQMMgr::recvPartQM().
int QMCoordMsg::pcSelMode |
Definition at line 110 of file ComputeQM.C.
Referenced by ComputeQM::processFullQM(), and ComputeQMMgr::recvPartQM().
int QMCoordMsg::sourceNode |
Definition at line 106 of file ComputeQM.C.
Referenced by ComputeQM::doWork(), ComputeQM::processFullQM(), ComputeQMMgr::procQMRes(), and ComputeQMMgr::recvPartQM().
int QMCoordMsg::timestep |
Definition at line 108 of file ComputeQM.C.
Referenced by ComputeQM::doWork(), and ComputeQMMgr::recvPartQM().