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Task

Biomolecular complex structure

Complex-structure evaluation tests predicted molecular arrangements against experimentally determined structures.

SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

0 evaluations · 0 metric rows

At a glance

Inputs, training, access and other details

Explanatory profile: source reviewed · Automated source review, 2026-09-16. Review applies to the cited claims; unresolved fields are listed below. Numerical results retain their own review status.

Data, procedure and scoring
PropertyDescription and evidence
Entity typeTask guide; concrete protocol identities remain separate.
SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
DatasetsNo single dataset is fixed by this guide. Select a linked protocol and its versioned data release. · Not applicable
SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
OrganismsNo shared organism population is defined at this guide level. Record it for each selected dataset. · Not applicable
SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
AssaysNo single measurement assay is fixed by this guide; the endpoint and assay belong to the selected protocol. · Not applicable
SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
SplitsNo executable split is attached to this task identity. Use the selected protocol’s split manifest. · Not applicable
SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
Allowed inputsMolecular sequences and chemical identities, with templates or alignments only where the protocol permits them; experimental reference structures for scoring.
SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
AdaptationNo common fitting regime is imposed here. Keep pretrained, frozen, probed, fine-tuned and conventional methods distinct where applicable. · Not applicable
SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
MetricsProtocol-specific structure and interface measures, such as LDDT, DockQ or interface LDDT. State the assessed entities and aggregation.
SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
BaselinesCompare structure predictors with matched partner definitions and input information. Different sampling budgets require separate reporting.
SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

How it works

How it worksConceptual evaluation workflow
Conceptual evaluation workflow1. Fix partners, references and allowed inputs. Then: 2. Predict complete complexes. Then: 3. Match equivalent chains and atoms. Then: 4. Score structures and interfacesConceptual evaluation workflow1. Fix partners, references and allowed inputs. Then: 2. Predict complete complexes. Then: 3. Match equivalent chains and atoms. Then: 4. Score structures and interfacesConceptual evaluation workflow1. Fix partners, references and allowed inputs. Then: 2. Predict complete complexes. Then: 3. Match equivalent chains and atoms. Then: 4. Score structures and interfaces

Conceptual task guide. Dataset preparation, parameters and scoring must come from a separately identified protocol.

SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
Choosing an evaluation

Declare the molecular partners and the input information available to each method. Assess the relevant chains and interfaces as well as the whole complex, using an explicit chain-assignment rule. Templates, alignments and sampling budgets belong to the evaluated configuration. A confidence estimate is not an experimental accuracy measurement.

SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
Task scope

This is a task guide, not a single versioned benchmark protocol. The connected resources provide examples or concrete procedures. A candidate method or proposed control is not evidence that an evaluation has been completed.

SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Tested entities and results

Release 2026-09-17-d277315f7d76 · 0 evaluations · 0 metric rows. Different protocols are not a single leaderboard.

No evaluations linked in this release.

Papers and result coverage

Last literature check: 2026-09-17. Dated primary-source discovery and protocol/table screening. Source checking does not mean experimental reproduction. Only separately extracted and independently reviewed numeric batches are publishable.

Paper or primary resourceVersionReference
Accurate structure prediction of biomolecular interactions with AlphaFold 3Primary full-text snapshot retrieved 2026-09-17; exact bytes pinned by SHA-256Read source
CASP16 Protein Monomer Structure Prediction AssessmentPrimary full-text snapshot retrieved 2026-09-17; exact bytes pinned by SHA-256Read source

What is still missing

  • complete comparable numeric result batch: Specific candidate tables and protocol boundaries are documented; no graph values or incomplete winner-only selection are converted into publishable rows.
Search and extraction details

primary protocol reviewed

Searches

  • AlphaFold 3 Boltz2 ligand pose benchmark paper 2025

Evidence locations

  • AF3 Fig. 1; Extended Data Table 1; CASP16 assessment Results

Strengths and limitations

Strengths supported by sources

  • Interface-specific scoring can reveal errors hidden by an otherwise accurate large component.
    SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Limitations and conditions

  • Agreement with one reference structure does not establish dynamics, binding affinity or every possible conformational state.
    SourcesAlphaFold 3 paper · Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set
Profile review details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Stable record: catalog-task-complex-structure

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.

17 evidence rows matching the loaded filters

Claims, original sources and review scope · Release 2026-09-17-d277315f7d76
Property and statementOriginal source and locationReview and provenance
Diagram caption

Conceptual task guide. Dataset preparation, parameters and scoring must come from a separately identified protocol.

Individual claims
AlphaFold 3 paper

Original source ↗

Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Version: Nature 2024; DOI 10.1038/s41586-024-07487-w; XML retrieved 2026-09-16
Retrieved: 2026-09-16T19:56:24.856478+00:00

source checked

automated source review · 2026-09-16

Audit details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Field: attributes.profile.diagram.caption

Source artifact SHA-256: e627083f74d990b275e96a7503eee3e3eae9e3035b8efb28321277fcac6f1d6e

Hash scope: primary_artifact_review

Inspected artifact

Diagram steps

["Fix partners, references and allowed inputs","Predict complete complexes","Match equivalent chains and atoms","Score structures and interfaces"]

Individual claims
AlphaFold 3 paper

Original source ↗

Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Version: Nature 2024; DOI 10.1038/s41586-024-07487-w; XML retrieved 2026-09-16
Retrieved: 2026-09-16T19:56:24.856478+00:00

source checked

automated source review · 2026-09-16

Audit details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Field: attributes.profile.diagram.steps

Source artifact SHA-256: e627083f74d990b275e96a7503eee3e3eae9e3035b8efb28321277fcac6f1d6e

Hash scope: primary_artifact_review

Inspected artifact

Diagram title

Conceptual evaluation workflow

Individual claims
AlphaFold 3 paper

Original source ↗

Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Version: Nature 2024; DOI 10.1038/s41586-024-07487-w; XML retrieved 2026-09-16
Retrieved: 2026-09-16T19:56:24.856478+00:00

source checked

automated source review · 2026-09-16

Audit details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Field: attributes.profile.diagram.title

Source artifact SHA-256: e627083f74d990b275e96a7503eee3e3eae9e3035b8efb28321277fcac6f1d6e

Hash scope: primary_artifact_review

Inspected artifact

Entity type

Task guide; concrete protocol identities remain separate.

Individual claims
AlphaFold 3 paper

Original source ↗

Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Version: Nature 2024; DOI 10.1038/s41586-024-07487-w; XML retrieved 2026-09-16
Retrieved: 2026-09-16T19:56:24.856478+00:00

source checked

automated source review · 2026-09-16

Audit details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Field: attributes.profile.facts.0.value

Source artifact SHA-256: e627083f74d990b275e96a7503eee3e3eae9e3035b8efb28321277fcac6f1d6e

Hash scope: primary_artifact_review

Inspected artifact

Datasets

No single dataset is fixed by this guide. Select a linked protocol and its versioned data release.

Individual claims
AlphaFold 3 paper

Original source ↗

Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Version: Nature 2024; DOI 10.1038/s41586-024-07487-w; XML retrieved 2026-09-16
Retrieved: 2026-09-16T19:56:24.856478+00:00

inapplicable

automated source review · 2026-09-16

Audit details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Field: attributes.profile.facts.1.value

Source artifact SHA-256: e627083f74d990b275e96a7503eee3e3eae9e3035b8efb28321277fcac6f1d6e

Hash scope: primary_artifact_review

Inspected artifact

Organisms

No shared organism population is defined at this guide level. Record it for each selected dataset.

Individual claims
AlphaFold 3 paper

Original source ↗

Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Version: Nature 2024; DOI 10.1038/s41586-024-07487-w; XML retrieved 2026-09-16
Retrieved: 2026-09-16T19:56:24.856478+00:00

inapplicable

automated source review · 2026-09-16

Audit details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Field: attributes.profile.facts.2.value

Source artifact SHA-256: e627083f74d990b275e96a7503eee3e3eae9e3035b8efb28321277fcac6f1d6e

Hash scope: primary_artifact_review

Inspected artifact

Assays

No single measurement assay is fixed by this guide; the endpoint and assay belong to the selected protocol.

Individual claims
AlphaFold 3 paper

Original source ↗

Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Version: Nature 2024; DOI 10.1038/s41586-024-07487-w; XML retrieved 2026-09-16
Retrieved: 2026-09-16T19:56:24.856478+00:00

inapplicable

automated source review · 2026-09-16

Audit details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Field: attributes.profile.facts.3.value

Source artifact SHA-256: e627083f74d990b275e96a7503eee3e3eae9e3035b8efb28321277fcac6f1d6e

Hash scope: primary_artifact_review

Inspected artifact

Splits

No executable split is attached to this task identity. Use the selected protocol’s split manifest.

Individual claims
AlphaFold 3 paper

Original source ↗

Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Version: Nature 2024; DOI 10.1038/s41586-024-07487-w; XML retrieved 2026-09-16
Retrieved: 2026-09-16T19:56:24.856478+00:00

inapplicable

automated source review · 2026-09-16

Audit details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Field: attributes.profile.facts.4.value

Source artifact SHA-256: e627083f74d990b275e96a7503eee3e3eae9e3035b8efb28321277fcac6f1d6e

Hash scope: primary_artifact_review

Inspected artifact

Allowed inputs

Molecular sequences and chemical identities, with templates or alignments only where the protocol permits them; experimental reference structures for scoring.

Individual claims
AlphaFold 3 paper

Original source ↗

Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Version: Nature 2024; DOI 10.1038/s41586-024-07487-w; XML retrieved 2026-09-16
Retrieved: 2026-09-16T19:56:24.856478+00:00

source checked

automated source review · 2026-09-16

Audit details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Field: attributes.profile.facts.5.value

Source artifact SHA-256: e627083f74d990b275e96a7503eee3e3eae9e3035b8efb28321277fcac6f1d6e

Hash scope: primary_artifact_review

Inspected artifact

Adaptation

No common fitting regime is imposed here. Keep pretrained, frozen, probed, fine-tuned and conventional methods distinct where applicable.

Individual claims
AlphaFold 3 paper

Original source ↗

Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set

Version: Nature 2024; DOI 10.1038/s41586-024-07487-w; XML retrieved 2026-09-16
Retrieved: 2026-09-16T19:56:24.856478+00:00

inapplicable

automated source review · 2026-09-16

Audit details

Reviewed named primary documentation and existing protocol records. Editorial task scope is distinguished from source-reported procedures. No model execution or new numerical result; a reviewed guide is not a complete runnable protocol.

Field: attributes.profile.facts.6.value

Source artifact SHA-256: e627083f74d990b275e96a7503eee3e3eae9e3035b8efb28321277fcac6f1d6e

Hash scope: primary_artifact_review

Inspected artifact

Sources and history

Release 2026-09-17-d277315f7d76 · Record review: discovered

6 source records and release historyDownload this release
Technical metadata and extraction receipts

Stable ID: catalog-task-complex-structure

areas
molecular-interactions
entity level
task
version
Not reported
task
Biomolecular complex structure
scope note
Predict joint structure for interacting proteins and other molecules.
benchmark research
review date: 2026-09-17; status: primary_protocol_reviewed; primary sources: evidence-expansion-alphafold3-e627083f; evidence-expansion-casp16-32ef3bdf; inspected locators: AF3 Fig. 1; Extended Data Table 1; CASP16 assessment Results; searched queries: AlphaFold 3 Boltz2 ligand pose benchmark paper 2025; gaps: complete comparable numeric result batch: Specific candidate tables and protocol boundaries are documented; no graph values or incomplete winner-only selection are converted into publishable rows.; claim scope: Dated primary-source discovery and protocol/table screening. Source checking does not mean experimental reproduction. Only separately extracted and independently reviewed numeric batches are publishable.
historical missing metadata
protocol version: not_yet_extracted
metadata review scope
historical_missing_metadata preserves the original discovery state. Current descriptive evidence and missingness are recorded in profile.facts; numerical-result review is separate.
legacy kinds
benchmark
entity classification
review date: 2026-09-17; rationale: This record identifies the biological prediction question or a suite-specific task, rather than a uniquely fixed evaluated procedure. Preserve its task identity and leave split, model adaptation and scoring details on linked protocols/evaluations.; source ids: evidence-alphafold-paper; source locator: Main text: Model architecture and Model limitations; Methods: Metrics and Recent PDB evaluation set; ambiguities: None recorded
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