| 88 |
|
} |
| 89 |
|
|
| 90 |
|
void setVelocitizer(Velocitizer* velocitizer) { |
| 91 |
< |
if (velocitizer_ != velocitizer && velocitizer_ != NULL) { |
| 91 |
> |
if (velocitizer_ != velocitizer && velocitizer_ != NULL) { |
| 92 |
|
delete velocitizer_; |
| 93 |
|
} |
| 94 |
< |
velocitizer_ = velocitizer; |
| 94 |
> |
velocitizer_ = velocitizer; |
| 95 |
|
} |
| 96 |
|
|
| 97 |
|
void setRNEMD(RNEMD* rnemd) { |
| 98 |
|
if (rnemd_ != rnemd && rnemd_ != NULL) { |
| 99 |
|
delete rnemd_; |
| 100 |
|
} |
| 101 |
< |
rnemd_ = rnemd; |
| 101 |
> |
rnemd_ = rnemd; |
| 102 |
|
} |
| 103 |
< |
|
| 103 |
> |
|
| 104 |
|
protected: |
| 105 |
|
|
| 106 |
|
Integrator(SimInfo* info); |
| 135 |
|
RealType statusTime; |
| 136 |
|
RealType thermalTime; |
| 137 |
|
RealType resetTime; |
| 138 |
< |
RealType RNEMD_swapTime; |
| 138 |
> |
RealType RNEMD_exchangeTime; |
| 139 |
|
RealType dt; |
| 140 |
|
|
| 141 |
|
Snapshot* currentSnapshot_; //During the integration, the address of currentSnapshot Will not change |
