| Receipt ID | Submitter Name | PI/Group Name | Number of Ligands | Kendall's τ | Kendall's τ Error | Spearman's ρ | Spearman's ρ Error | Method Name | Software | Method Type |
|---|---|---|---|---|---|---|---|---|---|---|
| 87q5m | Bogdan Iorga | Bogdan iorga | 3 | 0.33 | 0.61 | 0.5 | 0.65 | d3r-gc3-scoring-redocking-xray-score | cactvs chemoinformatics toolkit v3.433/schr_dinger suite 2016-1/glide/corina v3.60/ucsf chimera v1.10.2 | structure-based scoring |
| w6ue2 | Thomas Evangelidis | Thomas evangelidis | 14 | -0.33 | 0.2 | -0.43 | 0.26 | scaffopt_md5ns_score2 | ligprep v33013 scaffopt | structure-based scoring |
| ur83t | Thomas Evangelidis | Thomas evangelidis | 17 | -0.25 | 0.19 | -0.32 | 0.25 | scaffopt_md1ns_score2 | ligprep v33013 scaffopt | structure-based scoring |
| zfo0t | Bing Xie | David d.l. minh | 16 | 0.13 | 0.19 | 0.22 | 0.26 | algdock | openeye quacpac modeller 9.18 ucsf dock6 ambertools 14 namd 2.9 | structure-based scoring |
| 3tr6u | Thomas Evangelidis | Thomas evangelidis | 13 | -0.16 | 0.22 | -0.18 | 0.29 | scaffopt_md100ps_score2 | ligprep v33013 scaffopt | structure-based scoring |
| jjt0h | Thomas Evangelidis | Thomas evangelidis | 11 | -0.02 | 0.23 | 0.03 | 0.31 | scaffopt_stage2_ligscore2 | ligprep v33013 scaffopt | ligand-based scoring |