Variational Quantum Eigensolver for Clinical Biomarker Discovery: A Multi-Qubit Model

We formalize an inverse, data-conditioned variant of the Variational Quantum Eigensolver (VQE) for clinical biomarker discovery. Given patient-encoded quantum states, we construct a task-specific Hamiltonian whose coefficients are inferred from clinical associations and interpret its expectation value as a calibrated energy score for prognosis and treatment monitoring. The method integrates coefficient estimation, ansatz specification with basis rotations, commuting-group measurements, and a practical shot budget analysis. Evaluated on public infectious disease datasets under severe class imbalance, the approach yields consistent gains in balanced accuracy and precision–recall over strong classical baselines, with stability across random seeds and feature ablations. This variational energy scoring framework bridges Hamiltonian learning and clinical risk modeling, offering a compact, interpretable, and reproducible route to biomarker prioritization and decision support.

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Publication Details

Journal
Axioms
Published
2025-12-27
DOI
https://doi.org/10.3390/axioms15010023
Primary Topic
Quantum Computing Algorithms and Architecture
Type
article
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article

Variational Quantum Eigensolver for Clinical Biomarker Discovery: A Multi-Qubit Model

Juan Pablo Acuña González, Oscar Montiel, Moisés Sánchez Adame
Axioms
Quantum Computing Algorithms and Architecture
article

Variational Quantum Eigensolver for Clinical Biomarker Discovery: A Multi-Qubit Model

Juan Pablo Acuña González, Oscar Montiel, Moisés Sánchez Adame
article en

Abstract

We formalize an inverse, data-conditioned variant of the Variational Quantum Eigensolver (VQE) for clinical biomarker discovery. Given patient-encoded quantum states, we construct a task-specific Hamiltonian whose coefficients are inferred from clinical associations and interpret its expectation value as a calibrated energy score for prognosis and treatment monitoring. The method integrates coefficient estimation, ansatz specification with basis rotations, commuting-group measurements, and a practical shot budget analysis. Evaluated on public infectious disease datasets under severe class imbalance, the approach yields consistent gains in balanced accuracy and precision–recall over strong classical baselines, with stability across random seeds and feature ablations. This variational energy scoring framework bridges Hamiltonian learning and clinical risk modeling, offering a compact, interpretable, and reproducible route to biomarker prioritization and decision support.

AxiomsVol. 15(1)
Instituto Politécnico Nacional (MX)
Openalex Percentile: Top 18%
Quantum Computing Algorithms and Architecture
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Variational Quantum Eigensolver for Clinical Biomarker Discovery: A Multi-Qubit Model — Juan Pablo Acuña González, Oscar Montiel, et al. · Axioms (2025) | TGRS Research Map | TGRS