| # | Line 215 | Line 215 | int main(int argc,char* argv[]){ | |
|---|---|---|
| 215 | } | |
| 216 | } | |
| 217 | ||
| 218 | – | std::cerr << "nTarget before: " << n_h2o_target; |
| 219 | – | |
| 218 | n_h2o_target += n_deleted * n_lipids; | |
| 219 | ||
| 222 | – | std::cerr << ", after: " << n_h2o_target << ", n_deleted: " << n_deleted |
| 223 | – | << "\n"; |
| 224 | – | |
| 220 | // find a box size that best suits the number of waters we need. | |
| 221 | ||
| 222 | int done = 0; | |
| # | Line 285 | Line 280 | int main(int argc,char* argv[]){ | |
| 280 | ||
| 281 | n_water = n_cellX * n_cellY * n_cellZ * 4; | |
| 282 | ||
| 288 | – | std::cerr << "new waters = " << n_water << "\n"; |
| 289 | – | |
| 283 | delete[] waterX; | |
| 284 | delete[] waterY; | |
| 285 | delete[] waterZ; | |
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |