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MolTrace · SpectraCheck
Review spectral evidence, structure candidates, contradictions, and human sign-off.
Human review required · local session
AI spectral interpretation requires chemist review before final reporting. Session state is stored locally in this browser — not for regulated storage.
Spectroscopy · At a glance
Current SpectraCheck activity from saved sessions and local workbench state.
Local analysis activity only.
Spectroscopy · Triage
Top items from the human-review queue — full list lives in the Evidence Queue tab.
Estimated confidence
Confidence unavailable.
Model estimate only. Treat as decision support, not absolute truth.
Review: empty
Spectroscopy · Session context
Snapshot of the current backend session and any compound it is bound to.
Save or load a session to track session-level value.
Create or load a SpectraCheck session before linking a compound.
Spectroscopy · How it works
Two short reads — what the workflow does, and how to interpret the evidence panel.
From session inputs to a reviewer-ready report.
Set the session inputs above (project, sample, candidates, NMR text). Then use the tabs to upload spectra, run predictions, build cross-modal evidence, and generate a report.
Scores help you triage; the spectra decide.
Confidence numbers help prioritize what to review first. Cited measurements and the underlying spectra are the source of truth — not the score.
Spectroscopy · Readiness & impact
Pre-flight checks across analytical evidence, validation packages, and regulatory exposure.
Create or load a SpectraCheck session before running session-level QC.
validation coverage badge
0 SpectraCheck validation project record(s).
controlled record status for reports
Latest controlled record version: -.
data integrity status for session
No session ID selected.
Readiness summaries do not mark a session validated unless an approved backend status exists.
Bridge handoff to Regulatory Hub for review-required action items. Decision support only — not legal advice.
Create or select a regulatory dossier before creating dossier-linked regulatory action items.
Connect or create a SpectraCheck backend session to enable bridge handoff.
Extracted regulatory signals
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Created requirements
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Created action items
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Human review required
true
Warnings
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Notes
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Spectroscopy · Activity
Files attached to this session, downstream artifacts, and the most recent analysis runs.
Attach to session is available when a sessionId exists.
| filename | file size | SHA-256 | file kind | created date | session use | quality control |
|---|---|---|---|---|---|---|
| No session files found. | ||||||
Load or save a backend session to list artifacts.
| Title | Type | Job ID | Created | SHA-256 | Quality control | Actions |
|---|
Artifact types include: spectrum_preview, peak_table, processed_spectrum, nmr_metadata, msms_annotation, lcms_feature_table, unified_evidence, report_json, report_html, other.
No analysis jobs started yet.
Spectroscopy · GSD telemetry
Live aggregation of every spectrum.analyze_gsd event for this tenant — useful to size opt-in adoption and verify performance on your own data before the promotion gate clears.
SpectraCheck · Optional AI Prediction
Optional augmentation only. Existing scientific workflows remain unchanged and human review is required.
Pick a service, attach optional ID anchors (artifact / evidence / compound / session), then provide an input summary JSON. IDs and summaries only — never raw data.
Submit the prediction request to the controlled AI service. Returns a draft prediction that requires human review before use.