rewirebio.iobenchmarks
Result

Ligand pass rate of Chai-1 (MSA) on Runs N’ Poses complete-case intersection: 2,573 scored ligands (ESMFold2 Runs N’ Poses reported comparison split)

59% Ligand pass rate

Methods

Tested configuration
Chai-1 (MSA)
Protocol
ESMFold2 Runs N’ Poses reported comparison msa: Runs N’ Poses ligand pass rate (MSA)
Dataset subset
Runs N’ Poses complete-case intersection: 2,573 scored ligands (ESMFold2 Runs N’ Poses reported comparison split)
Related family profiles
Chai-1
Procedure
Runs N’ Poses receptor–ligand co-folding; source benchmark 2,600 systems. Figure 2C reports n=2,573 scored ligands on the intersection where all models produced valid predictions, after excluding undefined SuCOS scores. Multiple ligands in one system are scored independently. Five seeds × five diffusion samples per target; select top candidate by ipTM. Success requires lDDT-PLI >0.8 and BiSyRMSD <2 angstrom. Baselines use 10 recycles and 200 diffusion steps; ESMFold2 uses 10 or 20 loops as labelled and truncated 68-step diffusion. Single-sequence and MSA conditions remain separate.
Evaluation
Chai-1 (MSA) on ESMFold2 Runs N’ Poses reported comparison msa: Runs N’ Poses ligand pass rate (MSA)
Coverage
2573 ligands scored (Complete-case intersection; source 2600 systems is not a ligand denominator.)
Uncertainty
Not yet extracted
Evidence
Author-reported evaluation · source checkedESMFold2 primary paper v1, Figure 2C Runs N’ Poses · PDF page 5, Figure 2C, Runs N’ Poses subpanel (right), msa block, bar 5 from left (Chai-1 (MSA)), exact printed bar label

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

Reproduction

Split
Not reported
Adaptation
Not reported
Scoring implementation
Ligand pass rate

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.

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

Source checking verifies the cited claim or transcription. It does not establish independent reproduction.

Evidence table

Inspect claims, sources and review details

Trace each statement to its source and review. A context-only reference supports the record generally; it does not verify an individual field. Source checking does not reproduce an experiment.

One row per statement and cited source. Multiple citations are not independent evaluations. Shared locators are labelled explicitly.

1 evidence row matching the loaded filters

Claims, original sources and review scope · Release 2026-11-02-a7f03c9e55a5
Property and statementOriginal source and locationReview and provenance
Reported result
59
Individual claims
ESMFold2 primary paper v1, Figure 2C Runs N’ Poses

Original source ↗

PDF page 5, Figure 2C, Runs N’ Poses subpanel (right), msa block, bar 5 from left (Chai-1 (MSA)), exact printed bar label

Version: 10.64898/2026.06.03.729735v1; posted 2026-06-04
Retrieved: 2026-09-23T11:22:04.378019+00:00

source checked

["transcription","rendered-source-visual-check"] · 2026-09-23

author reported

Audit details

Source checked, not reproduced. Metrics differ by task, so no composite score across tasks is computed or implied.

Field: attributes.printed_value

Source artifact SHA-256: aacaf8d2c9af44cf148138b195175f2751295197bd5e3352ca6f1387059a7127

Hash scope: Hash scope not separately documented; inspect source record

Inspected artifact

Extraction artifact SHA-256: aacaf8d2c9af44cf148138b195175f2751295197bd5e3352ca6f1387059a7127

Extraction artifact

Sources and history

Release 2026-11-02-a7f03c9e55a5 · Record review: source checked

1 source record and release historyDownload this release (gzip)
Technical metadata and extraction receipts

Stable ID: esmfold2-2026-runs-n-poses-result-chai-1-msa-msa-ligand-pass-rate

areas
proteins-complexes
tasks
Runs N’ Poses ligand pass rate (MSA)
metric
ligand-pass-rate
metric direction
higher
unit
percent
printed value
59
numeric value
59
source locator
PDF page 5, Figure 2C, Runs N’ Poses subpanel (right), msa block, bar 5 from left (Chai-1 (MSA)), exact printed bar label
missing metadata
coverage.eligible: reason: unreported; denominator: reason: unextracted; seeds: reason: unreported; uncertainty: reason: unextracted
review
method: transcription; rendered-source-visual-check; reviewer: codex; date: 2026-09-23; artifact sha256: aacaf8d2c9af44cf148138b195175f2751295197bd5e3352ca6f1387059a7127; retrieval url: https://www.biorxiv.org/content/10.64898/2026.06.03.729735v1.full.pdf; method note: exact printed numerical labels in the complete Figure 2C Runs N’ Poses subpanel; visual original-PDF verification; no graph digitization; reviewer note: role: automated source review; note: Source checked, not reproduced. Metrics differ by task, so no composite score across tasks is computed or implied.
scored count
2573
coverage
unit: ligands; scored: 2573; note: Complete-case intersection; source 2600 systems is not a ligand denominator.
Related records

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