NAMD
|
#include <ComputeQM.h>
Public Member Functions | |
QMForce () | |
Public Attributes | |
int | replace |
Force | force |
int | homeIndx |
float | charge |
int | id |
Definition at line 101 of file ComputeQM.h.
|
inline |
Definition at line 107 of file ComputeQM.h.
float QMForce::charge |
Definition at line 105 of file ComputeQM.h.
Referenced by ComputeQMMgr::procQMRes(), ComputeQMMgr::recvPartQM(), ComputeQM::saveResults(), and ComputeQMMgr::storeQMRes().
Force QMForce::force |
Definition at line 103 of file ComputeQM.h.
Referenced by ComputeQMMgr::recvPartQM(), ComputeQM::saveResults(), and ComputeQMMgr::storeQMRes().
int QMForce::homeIndx |
Definition at line 104 of file ComputeQM.h.
Referenced by ComputeQMMgr::recvPartQM(), ComputeQMMgr::recvPntChrg(), and ComputeQM::saveResults().
int QMForce::id |
Definition at line 106 of file ComputeQM.h.
Referenced by ComputeQMMgr::recvPartQM(), and ComputeQM::saveResults().
int QMForce::replace |
Definition at line 102 of file ComputeQM.h.
Referenced by ComputeQMMgr::recvPartQM(), and ComputeQM::saveResults().