Quantum Chemistry Research Repository

Access in-depth studies on molecular simulations, electronic structure theories, and quantum computational advancements

Research Articles

Shot-Efficient ADAPT-VQE: Reducing Quantum Measurement Overhead with Pauli Reuse and Variance-Based Allocation

This article explores the critical challenge of quantum measurement overhead in the Adaptive Variational Quantum Eigensolver (ADAPT-VQE), a leading algorithm for molecular simulation on near-term quantum computers.

Kennedy Cole
Dec 02, 2025

Qubit-Wise Commutativity: A Practical Guide to Quantum Measurement Optimization for Biomedical Research

This article provides a comprehensive exploration of qubit-wise commutativity (QWC) and its critical role in optimizing quantum measurements for variational algorithms like the Variational Quantum Eigensolver (VQE).

Genesis Rose
Dec 02, 2025

CEO-ADAPT-VQE: A Resource-Efficient Quantum Algorithm for Molecular Simulation and Drug Discovery

This article explores the Coupled Exchange Operator (CEO) pool within the ADAPT-VQE framework, a novel quantum algorithm designed for the Noisy Intermediate-Scale Quantum (NISQ) era.

Wyatt Campbell
Dec 02, 2025

ADAPT-VQE: Principles, Optimizations, and Applications in Quantum-Accelerated Drug Discovery

This article provides a comprehensive exploration of the ADAPT-VQE (Adaptive Derivative-Assembled Pseudo-Trotter Variational Quantum Eigensolver) algorithm, a leading hybrid quantum-classical method for finding molecular ground states.

Lucas Price
Dec 02, 2025

Overcoming the Quantum Measurement Bottleneck: Strategies for Hybrid Algorithms in Drug Discovery

Hybrid quantum-classical algorithms represent a promising path to practical quantum advantage in drug discovery, but their performance is often constrained by a critical quantum measurement bottleneck.

Aurora Long
Dec 02, 2025

Understanding and Overcoming Barren Plateaus in Variational Quantum Algorithms: A Guide for Biomedical Research

Variational Quantum Algorithms (VQAs) offer a promising paradigm for tackling complex problems in drug development and biomedical research on near-term quantum devices.

Sofia Henderson
Dec 02, 2025

Adaptive Ansatz Construction: A Guide to Dynamic Quantum Algorithms for Drug Discovery

This article explores adaptive ansatz construction, a transformative technique in variational quantum algorithms that dynamically builds quantum circuits for superior performance.

Mia Campbell
Dec 02, 2025

Overcoming ADAPT-VQE Scaling Challenges: From Quantum Hardware Limits to Real-World Drug Discovery

This article provides a comprehensive analysis of the primary challenges in scaling the Adaptive Derivative-Assembled Problem-Tailored Variational Quantum Eigensolver (ADAPT-VQE) for practical quantum chemistry applications, particularly in drug discovery.

Paisley Howard
Dec 02, 2025

Overcoming the VQE Measurement Problem: A Guide to Precision Quantum Chemistry on NISQ Devices

The Variational Quantum Eigensolver (VQE) is a leading algorithm for finding molecular ground states on near-term quantum computers, with profound implications for drug discovery and materials science.

Caroline Ward
Dec 02, 2025

Beyond the Hype: Confronting ADAPT-VQE Limitations and Breakthroughs in the NISQ Era

This article provides a comprehensive analysis of the Adaptive Derivative-Assembled Pseudo-Trotter Variational Quantum Eigensolver (ADAPT-VQE) for quantum chemistry simulations in the Noisy Intermediate-Scale Quantum (NISQ) era.

Joshua Mitchell
Dec 02, 2025

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