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International Journal of Modern Physics C

Quantum neural networks for protein post-translational modification, protein function prediction and DNA analysis

Bac Trong Nguyen, Van-Nui Nguyen, Hiep L. Thi

Published Feb 12, 2026• 0 citations
Publisher

Abstract

Quantum Neural Networks (QNNs) are emerging as promising tools for complex biological data analysis due to their ability to exploit quantum mechanics for enhanced computational power. In Sec. 2 , we provide readers with a comprehensive overview of proteins, DNA sequencing, and recent updates on classical approaches to PTM prediction, protein function analysis and DNA analysis. Furthermore, we present recent findings that underscore the limitations of traditional methods and justify the need for quantum approaches. This section also highlights the unique advantages and potential benefits that quantum-based methods offer over classical techniques, paving the way for more powerful and accurate solutions in biological data analysis. These tasks are critical for understanding protein regulation, cellular processes and genetic information. In Sec. 3 , we provide a comprehensive review of various QNN architectures that have been proposed to date, categorized based on current theoretical and practical developments. The models discussed include Quantum McCulloch–Pitts (M–P) Neural Networks, Quantum Competitive Neural Networks, Quantum-Inspired Neural Networks, Quantum Dot Neural Networks, Quantum Cellular Neural Networks and Quantum Associative Neural Networks. Each of these models offers unique computational mechanisms rooted in quantum principles such as superposition, entanglement and interference, enabling them to capture complex patterns in high-dimensional biological data. We further highlight their potential and emerging applications in bioinformatics, particularly in the prediction of protein Post-translational Modifications (PTMs). Given the critical role of PTMs in regulating protein activity and cellular functions, leveraging QNNs provides a promising avenue for improving prediction accuracy and interpretability in large-scale proteomic datasets. In Sec. 4 , we present the latest advancements in the application of quantum machine learning in genomics, quantum computing for protein structure and function prediction, as well as quantum machine learning in drug discovery and molecular modeling. Section 5 discusses the current limitations of quantum hardware and the challenges in training quantum models. In Sec. 6 , we propose potential improvements for quantum machine learning models in bioinformatics, including hybrid quantum–classical architectures and more efficient quantum circuit designs. Finally, Sec. 7 concludes the review by summarizing the key insights and outlining specific future research directions, particularly focusing on extending our recent findings into the broader field of quantum machine learning. Together with a system of illustrative figures presented in Secs. 2 – 4 , as well as concrete examples of algorithms discussed in Sec. 4 , this review provides a solid foundation for future applications of quantum machine learning in bioinformatics and highlights the transformative potential of quantum models in revolutionizing biological data analysis.

DOI
10.1142/s0129183126430011

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Quantum Neural Networks (QNNs) are emerging as promising tools for complex biological data analysis due to their ability to exploit quantum mechanics for enhanced computational power. In Sec. 2 , we provide readers with a comprehensive overview of proteins, DNA sequencing, and recent updates on classical approaches to PTM prediction, protein function analysis and DNA analysis. Furthermore, we present recent findings that underscore the limitations of traditional methods and justify the need for quantum approaches. This section also highlights the unique advantages and potential benefits that quantum-based methods offer over classical techniques, paving the way for more powerful and accurate solutions in biological data analysis. These tasks are critical for understanding protein regulation, cellular processes and genetic information. In Sec. 3 , we provide a comprehensive review of various QNN architectures that have been proposed to date, categorized based on current theoretical and practical developments. The models discussed include Quantum McCulloch–Pitts (M–P) Neural Networks, Quantum Competitive Neural Networks, Quantum-Inspired Neural Networks, Quantum Dot Neural Networks, Quantum Cellular Neural Networks and Quantum Associative Neural Networks. Each of these models offers unique computational mechanisms rooted in quantum principles such as superposition, entanglement and interference, enabling them to capture complex patterns in high-dimensional biological data. We further highlight their potential and emerging applications in bioinformatics, particularly in the prediction of protein Post-translational Modifications (PTMs). Given the critical role of PTMs in regulating protein activity and cellular functions, leveraging QNNs provides a promising avenue for improving prediction accuracy and interpretability in large-scale proteomic datasets. In Sec. 4 , we present the latest advancements in the application of quantum machine learning in genomics, quantum computing for protein structure and function prediction, as well as quantum machine learning in drug discovery and molecular modeling. Section 5 discusses the current limitations of quantum hardware and the challenges in training quantum models. In Sec. 6 , we propose potential improvements for quantum machine learning models in bioinformatics, including hybrid quantum–classical architectures and more efficient quantum circuit designs. Finally, Sec. 7 concludes the review by summarizing the key insights and outlining specific future research directions, particularly focusing on extending our recent findings into the broader field of quantum machine learning. Together with a system of illustrative figures presented in Secs. 2 – 4 , as well as concrete examples of algorithms discussed in Sec. 4 , this review provides a solid foundation for future applications of quantum machine learning in bioinformatics and highlights the transformative potential of quantum models in revolutionizing biological data analysis.
The quantum-inspired neural architecture has a transformative capability for high-efficiency signal processing in the field of bioinformatics. Incorporating the principles of quantum computing in combination with classic neural networks, hybrid models use quantum superposition, entanglement, and parallelism to tackle difficult problems in biological data. As an example, the Quantum Spiking Neural Network (QSNN) combined with Quantum Long Short-Term Memory (QLSTM) modules can perform dynamic pattern recognition on genomic sequences and protein interaction predictions, which outperforms data efficiency in classical deep learning models. Quantum kernel methods also provide additional improvements in semantic classification tasks where quantum similarity is calculated between the biological data points, as can be seen in the analysis of gene expression with Quantum Kernel Support Vector Machines (QK-SVM). Areas of application include the transcriptomics classification of cancer using quantum k-means clustering, the optimization of gene regulatory networks, and fast drug discovery by means of quantum-enhanced literature mining. Such architectures both lower computational complexity and accelerate convergence rates - quantum-inspired backpropagation mechanisms, as an example, optimize weight updates 30% faster than classical counterparts in molecular dynamics simulations. The convergence of quantum-inspired algorithms and bioinformatics promises to not only solve the scalability problem in multi-omics data but also explore new methods of real-time adaptive learning in noisy biological settings
Quantum Neural Networks (QNNs) represent a novel computational paradigm that merges the principles of quantum computing with the architecture of artificial neural networks. Through the quantum phenomena of superposition, entanglement, and interference, QNNs enable parallel computation in high-dimensional Hilbert spaces, offering the potential to surpass the representational limits of classical models. This review provides a comprehensive overview of the theoretical foundations and architectures of QNNs, including Quantum Perceptrons, Variational Quantum Circuits (VQCs), Quantum Convolutional Neural Networks (QCNNs), and Quantum Recurrent Neural Networks (QRNNs). Furthermore, it discusses hybrid quantum–classical training mechanisms and key challenges such as barren plateaus, decoherence, and sampling complexity. The review also highlights recent applications of QNNs in medical diagnostics, materials science, and financial forecasting, demonstrating their potential to accelerate computation and improve predictive accuracy. Finally, future research directions are discussed in relation to computational efficiency, model interpretability, and integration with next-generation quantum hardware.
Computational methods in drug discovery significantly reduce both time and experimental costs. Nonetheless, certain computational tasks in drug discovery can be daunting with classical computing techniques which can be potentially overcome using quantum computing. A crucial task within this domain involves the functional classification of proteins. However, a challenge lies in adequately representing lengthy protein sequences given the limited number of qubits available in existing noisy quantum computers. We show that protein sequences can be thought of as sentences in natural language processing and can be parsed using the existing Quantum Natural Language framework into parameterized quantum circuits of reasonable qubits, which can be trained to solve various proteinrelated machine-learning problems. We classify proteins based on their sub-cellular locations—a pivotal task in bioinformatics that is key to understanding biological processes and disease mechanisms. Leveraging the quantum-enhanced processing capabilities, we demonstrate that Quantum Tensor Networks (QTN) can effectively handle the complexity and diversity of protein sequences. We present a detailed methodology that adapts QTN architectures to the nuanced requirements of protein data, supported by comprehensive experimental results. We demonstrate two distinct QTNs, inspired by classical recurrent neural networks (RNN) and convolutional neural networks (CNN), to solve the binary classification task mentioned above. Our top-performing quantum model has achieved a 94% accuracy rate, which is comparable to the performance of a classical model that uses the ESM2 protein language model embeddings. It’s noteworthy that the ESM2 model is extremely large, containing 8 million parameters in its smallest configuration, whereas our best quantum model requires only around 800 parameters. We demonstrate that these hybrid models exhibit promising performance, showcasing their potential to compete with classical models of similar complexity.
Computational methods in drug discovery significantly reduce both time and experimental costs. Nonetheless, certain computational tasks in drug discovery can be daunting with classical computing techniques which can be potentially overcome using quantum computing. A crucial task within this domain involves the functional classification of proteins. However, a challenge lies in adequately representing lengthy protein sequences given the limited number of qubits available in existing noisy quantum computers. We show that protein sequences can be thought of as sentences in natural language processing and can be parsed using the existing Quantum Natural Language framework into parameterized quantum circuits of reasonable qubits, which can be trained to solve various protein-related machine-learning problems. We classify proteins based on their sub-cellular locations—a pivotal task in bioinformatics that is key to understanding biological processes and disease mechanisms. Leveraging the quantum-enhanced processing capabilities, we demonstrate that Quantum Tensor Networks (QTN) can effectively handle the complexity and diversity of protein sequences. We present a detailed methodology that adapts QTN architectures to the nuanced requirements of protein data, supported by comprehensive experimental results. We demonstrate two distinct QTNs, inspired by classical recurrent neural networks (RNN) and convolutional neural networks (CNN), to solve the binary classification task mentioned above. Our top-performing quantum model has achieved a 94% accuracy rate, which is comparable to the performance of a classical model that uses the ESM2 protein language model embeddings. It’s noteworthy that the ESM2 model is extremely large, containing 8 million parameters in its smallest configuration, whereas our best quantum model requires only around 800 parameters. We demonstrate that these hybrid models exhibit promising performance, showcasing their potential to compete with classical models of similar complexity.
Quantum Neural Networks (QNNs) have emerged as a promising avenue in the quest for next-generation machine learning capabilities.By harnessing the principles of quantum mechanics and quantum computing, QNNs offer the potential for exponential speedup and enhanced computational power compared to classical machine learning algorithms.This paper presents a comprehensive exploration of Quantum Neural Networks, covering their foundational concepts, various architectures, novel quantum-enhanced machine learning algorithms, practical implementations, advantages, and challenges.We begin with an overview of related work in Quantum Machine Learning, highlighting the achievements and progress in the field.Subsequently, we delve into the fundamental principles of Quantum Mechanics and Quantum Computing to provide a solid grounding for understanding QNNs.We then introduce the basics of Quantum Neural Networks, including quantum neurons, quantum gates, and quantum circuits for machine learning tasks.Various QNN architectures, such as Variational Quantum Circuits and Quantum Convolutional Neural Networks, are explored along with their potential applications.Additionally, quantum-enhanced machine learning algorithms, like Quantum Support Vector Machines and Quantum Generative Adversarial Networks, are discussed for a deeper understanding of QNN capabilities.Practical aspects, including hardware implementations, noise mitigation, and experimental results, are presented to shed light on the feasibility of QNNs in real-world scenarios.The paper concludes by discussing the advantages and challenges of Quantum Neural Networks and their potential implications for the future of machine learning and artificial intelligence.
One of the most promising new directions in quantum computing and artificial intelligence convergence is the Quantum Neural Networks (QNNs) that can potentially revolutionize the manner in which intelligent systems are designed, trained, and implemented. Although traditional deep learning models have proven to be incredibly successful in fields like computer vision, natural language processing and autonomous systems, they are becoming limited by computational bottlenecks, energy use, and scalability constraints when operating on large high-dimensional data. The distinctive principles of quantum mechanics (superposition, entanglement, and quantum parallelism) may be applied to the QNNs to provide a distinct computational paradigm with the ability to execute exponentially complicated computations more effectively than his classical counterparts. This article gives an in-depth analysis of QNNs as the new frontier of artificial intelligence. We start with the description of the theoretical foundations of quantum computation and their realization in the form of neural networks. We then examine state-of-the-art QNN architectures, such as hybrid quantum-classical models that help overcome present quantum hardware limitations in relation to the capabilities of classical machine learning. Some of the upcoming applications are showcased including molecular simulation and drug discovery and financial modeling, optimization, cryptography and intelligent automation. Such applications reveal the revolutionary power of QNNs to tackle the issues that cannot be tackled by traditional systems. Nonetheless, there are also major obstacles on the way to a practical implementation of QNN. Problems that still remain a barrier to widespread adoption include quantum decoherence, noise in near-term quantum devices, and the inability to scale qubit architectures or to train large-scale quantum models. In order to overcome these obstacles, we speak about the current research work on the topic of error correction, variational algorithms, and hybrid system designs. Also we examine the ethical and societal ramifications of quantum-accelerated AI, such as security, data sovereignty, and technological equity globally.