WF-15 · Virtual Analyzer

Virtual Analyzer

Estimates product quality between laboratory assays with delay, noise, point-in-time controls, OOD detection and measurable abstention.

Experimental · simulated laboratoryEvery 6 h: 01:50/07:50/13:50/19:50 UTCIndustry · quality · soft sensor
Demonstration card: workflow summary, not evidence from a real plant.
1 · In one sentence

Estimates product quality between laboratory assays with delay, noise, point-in-time controls, OOD detection and measurable abstention.

2 · Why it exists

Estimate a quality property between laboratory assays without using future truth, while showing when the model is out of domain and should abstain.

3 · What it produces

Estimate/split-conformal interval, domain status, OOD check and frozen-benchmark context.

The images come from demonstration runs included in the attached repository and are shown without dates to illustrate workflow structure, method and evidence.

Workflow overview and primary output.
Calculation method and pipeline.
Evidence, metrics or checks from the demonstration run.
History, sensitivities or validation context.

4 · How it works

From data to output, with explicit controls.

1Synthetic process sensors
2Delayed laboratory with noise/QC
3Linear/PLS/Ridge/RF/GB comparison
4Split-conformal calibration
5Isolation Forest OOD
6Abstention and risk-coverage diagnostics

Transferable pattern: Delayed-label estimation + OOD abstention.

5 · Data, AI/ML/RPA and method

Data and features

process sensors + delayed laboratory with noise/QC

Calculation / inference

Linear, PLS, Ridge, Random Forest, Gradient Boosting; Isolation Forest OOD

Validation

RMSE/MAE/bias/coverage, skill versus last lab, split-conformal and truth-vs-lab; risk-coverage diagnostic only

Stack

Python, pandas, scikit-learn, SQLite, Matplotlib

6 · Technical dossier

Operating conditions and declared limitations.

Compute cadenceEvery 6 h: 01:50/07:50/13:50/19:50 UTC
Planned publicationIT Sat 10:30; EN Sat 16:30
Possible applicationssoft sensing, inferential measurement and quality monitoring
Research useconformal coverage, OOD as domain distance and model error versus laboratory uncertainty
Required conditiontruth and laboratory are simulated; no real performance claim
Failure modeleakage from true values or a soft sensor answering outside its domain
Interpretation boundary

Process, truth and laboratory are simulated. Coverage and skill describe the stated benchmark; real use requires plant data, Gage R&R/QC and prospective validation.

7 · Verification and further reading

Read the workflow in the wider laboratory context.