Table III.
Evaluation of high throughput capability of DockoMatic. Mock experiment results showing the number of jobs in each trial, the length of time to submit jobs, and the job completion time based on output file preparation.
| Number of Jobs | Initiation time (sec)* | Completion time** |
|---|---|---|
| 100 | < 1 | 51 sec |
| 1000 | < 1 | 8.7 min |
| 10,000 | 8 | 1.57 hrs |
| 100,000 | 231 | ~15 hrsξ |
| 1,000,000 | ~1 weekξ |
*
Time required to create job submission directories and populate grid boxes.
**
Time required to copy dlg and pdb reference files into output directories.
ξ
Estimated time.