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Summary of CASF-2016 benchmark categories.
| Category | Aim of a Category | Metric |
|---|---|---|
| Scoring | How well the scoring function correlates with the experimental binding affinities? | Pearson correlation coefficient |
| Ranking | How relative order of binding affinities is correctly predicted? | Spearman correlation coefficient Kendall tau Predictive index |
| Docking | Can the scoring function find the native ligand binding pose? | Top 1 (%), Top 2 (%), Top 3(%) |
