#include <ParallelIOMgr.h>
Public Attributes | |
| int | numBonds |
| int | numCalcBonds |
| int | numAngles |
| int | numCalcAngles |
| int | numDihedrals |
| int | numCalcDihedrals |
| int | numImpropers |
| int | numCalcImpropers |
| int | numCrossterms |
| int | numCalcCrossterms |
| int64 | numExclusions |
| int64 | numCalcExclusions |
| int64 | numCalcFullExclusions |
| int | numLJPairs |
| int | numCalcLJPairs |
| int | numRigidBonds |
| BigReal | totalMass |
| Vector | totalMV |
| BigReal | totalCharge |
Detailed Description
Definition at line 34 of file ParallelIOMgr.h.
Member Data Documentation
◆ numAngles
| int MolInfoMsg::numAngles |
Definition at line 39 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numBonds
| int MolInfoMsg::numBonds |
Definition at line 37 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numCalcAngles
| int MolInfoMsg::numCalcAngles |
Definition at line 40 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numCalcBonds
| int MolInfoMsg::numCalcBonds |
Definition at line 38 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numCalcCrossterms
| int MolInfoMsg::numCalcCrossterms |
Definition at line 46 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numCalcDihedrals
| int MolInfoMsg::numCalcDihedrals |
Definition at line 42 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numCalcExclusions
| int64 MolInfoMsg::numCalcExclusions |
Definition at line 48 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numCalcFullExclusions
| int64 MolInfoMsg::numCalcFullExclusions |
Definition at line 49 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numCalcImpropers
| int MolInfoMsg::numCalcImpropers |
Definition at line 44 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numCalcLJPairs
| int MolInfoMsg::numCalcLJPairs |
Definition at line 51 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::updateMolInfo().
◆ numCrossterms
| int MolInfoMsg::numCrossterms |
Definition at line 45 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numDihedrals
| int MolInfoMsg::numDihedrals |
Definition at line 41 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numExclusions
| int64 MolInfoMsg::numExclusions |
Definition at line 47 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numImpropers
| int MolInfoMsg::numImpropers |
Definition at line 43 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ numLJPairs
| int MolInfoMsg::numLJPairs |
Definition at line 50 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::updateMolInfo().
◆ numRigidBonds
| int MolInfoMsg::numRigidBonds |
Definition at line 53 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ totalCharge
| BigReal MolInfoMsg::totalCharge |
Definition at line 60 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ totalMass
| BigReal MolInfoMsg::totalMass |
Definition at line 57 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
◆ totalMV
| Vector MolInfoMsg::totalMV |
Definition at line 58 of file ParallelIOMgr.h.
Referenced by ParallelIOMgr::bcastMolInfo(), ParallelIOMgr::recvMolInfo(), and ParallelIOMgr::updateMolInfo().
The documentation for this class was generated from the following file:
