Table 3.
Compound library comparison performance using integer fingerprint algorithm on machine 3
Reference and Candidate Libraries | Time (sec) | Throughput (kTanimotos/sec) | Effective Bandwidth (GB/sec) |
---|---|---|---|
A vs A | 0.47 | 209507 | 26.43 |
A vs B | 0.95 | 257483 | 32.68 |
A vs C | 2.12 | 261684 | 33.18 |
B vs A | 0.94 | 261884 | 33.03 |
B vs B | 2.29 | 267136 | 33.90 |
B vs C | 4.85 | 286175 | 36.26 |
C vs A | 2.00 | 278064 | 35.17 |
C vs B | 4.80 | 288914 | 36.63 |
C vs C | 11.37 | 276519 | 35.03 |