Role of quantum computing in accelerating drug discovery process

Ganesan, Nirmala and Rahul, R. and Sibi Sidharth, S. (2025) Role of quantum computing in accelerating drug discovery process. In: Innovations in Biomedical Engineering. Elsevier, pp. 411-435.

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Abstract

This chapter investigates the application of a variational quantum eigen solver and other quantum algorithms to drug development. The uses and constraints of quantum algorithms, such as the variational quantum eigen solver, are discusses. This article examines the usefulness of variational quantum eigen solver and other quantum algorithms to drug development, while also highlighting the limitations and application areas of quantum algorithms. A paradigm shift has occurred in the pharmaceutical business with the introduction of quantum computing, as formerly unimaginable computational powers to expedite the drug discovery process have become achievable. Examining how quantum computing is changing the field, this research shows how it can significantly increase the accuracy and effectiveness of drug discovery, virtual screening, and molecular simulations.
Quantum computers use quantum physics techniques to perform calculations that are more complex than possible with their classical equivalents. These systems, by utilizing quantum parallelism and entanglement, may probe huge chemical areas much faster than classical approaches. This study investigates the application of quantum algorithms, particularly variational quantum eigen solvers, in drug development. Hybrid quantum-classical technologies present a viable solution to surmount the constraints of quantum technology and enhance the scalability of drug development processes. These technologies blend quantum computing with classical approaches.
The report discusses the most recent advancements in this hybrid paradigm and highlights collaborative efforts between experts in quantum computing and academics researching drugs. As technology develops, quantum computing becomes more and more significant for drug discovery. The groundbreaking effects of quantum computing on drug development and its potential to drastically alter the pharmaceutical research landscape are highlighted in the conclusion of this chapter. Through the application of quantum computing, drug development processes stand to benefit greatly from a new age of efficacy and efficiency brought about by addressing current problems and embracing innovative ideas.

Item Type: Book Section
Subjects: Pharmaceutics > Drug Delivery System
Domains: Bioengineering
Depositing User: Mr IR Admin
Date Deposited: 21 Aug 2025 10:42
Last Modified: 21 Aug 2025 10:42
URI: https://ir.vistas.ac.in/id/eprint/10267

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