Skip to main content

Table 6 The average number of ACSKs per an assay revealed by the Morgan2, rv-QAFFP and b-QAFFP fingerprints in 22 CLASS sets

From: QSAR-derived affinity fingerprints (part 1): fingerprint construction and modeling performance for similarity searching, bioactivity classification and scaffold hopping

  Morgan2 rv-QAFFP b-QAFFP rv+b-QAFFP
Average # of ACSKs 39.27 ± 8.25 41.41 ± 8.51 48.41 ± 10.37 52.10 ± 11.12
  1. In addition, the union of ACSKs revealed by both rv-QAFFP and b-QAFFP is reported. Averages are shown together with their standard errors of the mean. Additional file 4 contains detailed information about the number of revealed ACSKs for individual assays