Result

42.1 Forward-screening success rate

Vina · Forward-screening success rate · CASF-2016 blind docked poses

Tested configuration: Vina
Task: Protein–ligand virtual screening
Dataset: CASF-2016 blind docked poses
Procedure: Vina scoring on the same DiffDock-NMDN blind docked poses; not ligand-pose RMSD.
Evaluation: Vina: Protein–ligand virtual screening
Coverage: scored: unreported; eligible: unreported
Uncertainty: Not reported
Evidence: Independent external evaluation · source checkedNormalized Protein–Ligand Distance Likelihood Score for End-to-End Blind Docking and Virtual Screening · Table 2, Vina scoring row, success rate (%) column

A source-checked result verifies the numerical transcription, not every model or protocol detail. Evaluation metadata: needs review. Source checked does not mean independently reproduced.

Reproduction

Split: Not reported
Adaptation: Not reported
Scoring implementation: Not reported

No execution recipe has been verified for this exact configuration and evaluation. A benchmark's general instructions may use different inputs, splits or model settings.

Access requirements and official instructions: Protein–ligand virtual screening

Reproducing this published result requires matching its model configuration, data, split and scorer. Source checking or a successful smoke test does not establish score reproduction.

Evidence

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1 evidence row matching the loaded filters

Claims, original sources and review scope · Release 2026-09-29-06401fd5b220
Property and statement	Original source and location	Review and provenance
attributes.printed_value 42.1 Individual claims	Normalized Protein–Ligand Distance Likelihood Score for End-to-End Blind Docking and Virtual Screening Original source ↗ Table 2, Vina scoring row, success rate (%) column Version: version of record Retrieved: 2026-09-16T10:41:16.552697+00:00	source checked independent ai table review · 2026-09-16T10:41:16.554518+00:00 independent paper Audit details All scoring functions share DiffDock-NMDN poses via rowspan. Selected forward-screening success percentage, not docking pose success or scoring-power correlation. This verifies the central score at its source location, not every metadata field or an experimental reproduction. Field: `attributes.printed_value` Claim: claim-lit-044 Source artifact SHA-256: `194b21478aaedd9a7384cabb8b0040ca5b6a4938f4d275627b86a6b787affc20` Hash scope: Hash scope not separately documented; inspect source record Inspected artifact Extraction artifact SHA-256: `194b21478aaedd9a7384cabb8b0040ca5b6a4938f4d275627b86a6b787affc20` Extraction artifact

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Release 2026-09-29-06401fd5b220 · Record review: source checked

1 source records and release history

Normalized Protein–Ligand Distance Likelihood Score for End-to-End Blind Docking and Virtual Screening · Original source · version of record

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Technical metadata and extraction receipts

Stable ID: lit-044

areas: molecular-interactions
tasks: Protein–ligand virtual screening
printed value: 42.1
numeric value: 42.1
metric: Forward-screening success rate
metric direction: unknown
unit: %
uncertainty: Not reported
source locator: Table 2, Vina scoring row, success rate (%) column
review: method: independent_ai_table_review; reviewer: Codex omics research agent; independent source-table review, not human review; reviewed at: 2026-09-16T10:41:16.554518+00:00; notes: All scoring functions share DiffDock-NMDN poses via rowspan. Selected forward-screening success percentage, not docking pose success or scoring-power correlation. This verifies the central score at its source location, not every metadata field or an experimental reproduction.; evidence: {"table_xml_id": "tbl2", "row_cells": ["Vina38", "15.18", "42.1", "0.340", "0.323"], "selected_cell_zero_based": 2, "selected_cell_xml": "<td style=\"border:none;\" align=\"center\" colspan=\"1\" rowspan=\"1\">42.1</td>", "caption": "Performance of Representative Scoring Functions on the CASF-2016 Using the DiffDock-NMDN Blind Docked Posesa"}; artifact sha256: 194b21478aaedd9a7384cabb8b0040ca5b6a4938f4d275627b86a6b787affc20; retrieval url: https://www.ebi.ac.uk/europepmc/webservices/rest/PMC11815853/fullTextXML
legacy id: lit-044
legacy row: id: lit-044; paper id: nmdn-2025; domain id: molecular-interactions; task: Protein–ligand virtual screening; model: Vina; model version: Not reported; dataset: CASF-2016 blind docked poses; dataset version: Not reported; split: Not reported; metric: Forward-screening success rate; value: 42.1; unit: %; uncertainty: Not reported; protocol: Vina scoring on the same DiffDock-NMDN blind docked poses; not ligand-pose RMSD.; source locator: Table 2, Vina scoring row, success rate (%) column; source url: https://pmc.ncbi.nlm.nih.gov/articles/PMC11815853/; evaluation origin: independent_paper; reviewed utc: 2026-09-15T23:25:00Z
missing metadata: model version: not_reported_in_legacy_extract; dataset version: not_reported_in_legacy_extract; split: not_reported_in_legacy_extract; uncertainty: not_reported_in_legacy_extract

Related records

evaluation: Vina: Protein–ligand virtual screening
subject: Reported Forward-screening success rate for Vina

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