This paper-specific evaluation tests Protein–ligand binding affinity scoring using CASF-2016.
Explanatory profile: limited source coverage · Automated source review, 2026-09-16. This does not change the review status of its results.
| Property | Description and evidence |
|---|---|
| Record type | Paper-specific task; protocol incompletely extractedAK-Score: Accurate Protein-Ligand Binding Affinity Prediction Using an Ensemble of 3D-Convolutional Neural Networks · Table 2, AK-score-ensemble / learning rate 0.0007 row, Scoring Pearson (R) column; Table 2, AK-score-single / learning rate 0.0007 row, Scoring Pearson (R) column |
| Inputs | CASF-2016AK-Score: Accurate Protein-Ligand Binding Affinity Prediction Using an Ensemble of 3D-Convolutional Neural Networks · Table 2, AK-score-ensemble / learning rate 0.0007 row, Scoring Pearson (R) column; Table 2, AK-score-single / learning rate 0.0007 row, Scoring Pearson (R) column |
| Assessment | Pearson RAK-Score: Accurate Protein-Ligand Binding Affinity Prediction Using an Ensemble of 3D-Convolutional Neural Networks · Table 2, AK-score-ensemble / learning rate 0.0007 row, Scoring Pearson (R) column; Table 2, AK-score-single / learning rate 0.0007 row, Scoring Pearson (R) column |
| Recorded split or evaluation setting | UnextractedAK-Score: Accurate Protein-Ligand Binding Affinity Prediction Using an Ensemble of 3D-Convolutional Neural Networks · Table 2, AK-score-ensemble / learning rate 0.0007 row, Scoring Pearson (R) column; Table 2, AK-score-single / learning rate 0.0007 row, Scoring Pearson (R) column |
| Datasets | Not extracted or verified for this record. |
| Organisms | Not extracted or verified for this record. |
| Assays | Not extracted or verified for this record. |
| Adaptation | Not extracted or verified for this record. |
| Baselines | Not extracted or verified for this record. |
Outline of the existing paper extraction. Split membership, fitting details and scorer implementation remain incompletely reviewed.
The existing paper extraction describes: CASF-2016 scoring-power evaluation. This description is retained with the exact evaluation records; it is not a new protocol reconstruction.
AK-Score: Accurate Protein-Ligand Binding Affinity Prediction Using an Ensemble of 3D-Convolutional Neural Networks · Table 2, AK-score-ensemble / learning rate 0.0007 row, Scoring Pearson (R) column; Table 2, AK-score-single / learning rate 0.0007 row, Scoring Pearson (R) columnRelease 2026-09-16-d74d282221a9 · 2 evaluations · 2 metric rows. Different protocols are not a single leaderboard.
| Metric and finding | Coverage and uncertainty | Evidence |
|---|---|---|
| AK-score-ensemble: Protein–ligand binding affinity scoring CASF-2016 scoring-power evaluation. Author-reported evaluation · Evaluation metadata: needs review | ||
| 0.812 Pearson R Unit: unitless · Direction: unknown | Uncertainty: not reported in legacy extract Scored: Not reported · Eligible: Not reported | source checkedAK-Score: Accurate Protein-Ligand Binding Affinity Prediction Using an Ensemble of 3D-Convolutional Neural Networks · Table 2, AK-score-ensemble / learning rate 0.0007 row, Scoring Pearson (R) column Source checking is not independent reproduction. |
| AK-score-single: Protein–ligand binding affinity scoring CASF-2016 scoring-power evaluation. Author-reported evaluation · Evaluation metadata: needs review | ||
| 0.759 Pearson R Unit: unitless · Direction: unknown | Uncertainty: not reported in legacy extract Scored: Not reported · Eligible: Not reported | source checkedAK-Score: Accurate Protein-Ligand Binding Affinity Prediction Using an Ensemble of 3D-Convolutional Neural Networks · Table 2, AK-score-single / learning rate 0.0007 row, Scoring Pearson (R) column Source checking is not independent reproduction. |
Catalogue extraction inspected; protocol claims remain limited to the cited evidence. Missing details are not presumed absent from the original paper.
Stable record: reported-task-a78312d5df6dadRelease 2026-09-16-d74d282221a9 · Record review: needs review
Stable ID: reported-task-a78312d5df6dad