| # | Line 294 | Line 294 | |
|---|---|---|
| 294 | } | |
| 295 | if (ierr == TRUE) | |
| 296 | goto L_10; | |
| 297 | + | if (ierr != TRUE) |
| 298 | + | { |
| 299 | + | Missing_constants = TRUE; |
| 300 | + | sprintf(hatext,"Bond constants missing for bond %d - %d of type %d - %d\n",bonds_ff.i12[i][0],bonds_ff.i12[i][1], |
| 301 | + | atom[bonds_ff.i12[i][0]].type, atom[bonds_ff.i12[i][1]].type); |
| 302 | + | fprintf(pcmlogfile,"%s\n",hatext); |
| 303 | + | // fprintf(errfile,"%s\n",hatext); |
| 304 | + | } |
| 305 | L_10: | |
| 306 | continue; | |
| 307 | ||
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |