52 |
|
needReset(false), velocitizer_(NULL), needVelocityScaling(false), |
53 |
|
rnemd_(NULL), useRNEMD(false), rotAlgo_(NULL), flucQ_(NULL), |
54 |
|
rattle_(NULL), dumpWriter(NULL), statWriter(NULL), thermo(info), |
55 |
< |
currentSnapshot_(info->getSnapshotManager()->getCurrentSnapshot()) { |
55 |
> |
snap(info->getSnapshotManager()->getCurrentSnapshot()) { |
56 |
|
|
57 |
|
simParams = info->getSimParams(); |
58 |
|
|
94 |
|
} |
95 |
|
|
96 |
|
if (!simParams->getUseInitalTime()) { |
97 |
< |
currentSnapshot_->setTime(0.0); |
97 |
> |
snap->setTime(0.0); |
98 |
|
} |
99 |
|
|
100 |
|
if (simParams->haveResetTime()) { |