| 124 | 
  | 
    RealType gridX_, gridY_; | 
| 125 | 
  | 
    RealType halfBoxX_, halfBoxY_; | 
| 126 | 
  | 
 | 
| 127 | 
– | 
    int binNoX, binNoY; | 
| 127 | 
  | 
    RealType interpsum, value; | 
| 128 | 
  | 
    int ninterp, px, py, newp; | 
| 129 | 
< | 
    int newx, newy, newindex, index; | 
| 129 | 
> | 
    int newindex, index; | 
| 130 | 
  | 
    int new_i, new_j, new_index; | 
| 131 | 
  | 
 | 
| 132 | 
  | 
    RealType freq_x, freq_y, zero_freq_x, zero_freq_y, freq; | 
| 133 | 
  | 
    RealType maxfreqx, maxfreqy, maxfreq; | 
| 134 | 
  | 
 | 
| 135 | 
  | 
    int whichbin; | 
| 137 | 
– | 
    int nMolecules; | 
| 136 | 
  | 
 | 
| 137 | 
  | 
    std::fill(sum_bin.begin(), sum_bin.end(), 0.0); | 
| 138 | 
  | 
    std::fill(avg_bin.begin(), avg_bin.end(), 0.0); | 
| 153 | 
  | 
       | 
| 154 | 
  | 
      reader.readFrame(istep); | 
| 155 | 
  | 
      currentSnapshot_ = info_->getSnapshotManager()->getCurrentSnapshot(); | 
| 158 | 
– | 
      nMolecules = info_->getNGlobalMolecules(); | 
| 156 | 
  | 
       | 
| 157 | 
  | 
      Mat3x3d hmat = currentSnapshot_->getHmat(); | 
| 158 | 
  | 
       |