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Published on: September 26, 2025
Application of artificial intelligence and machine learning for COVID-19 drug discovery and vaccine design
Hao Lv1, Lei Shi2, Joshua William Berkenpas3
1Center for Informational Biology, University of Electronic Science and Technology of China, Chengdu 610054, China.
Abstract:
The global pandemic of coronavirus disease 2019 (COVID-19), caused by severe acute respiratory syndrome coronavirus 2, has led to a dramatic loss of human life worldwide. Despite many efforts, the development of effective drugs and vaccines for this novel virus will take considerable time. Artificial intelligence (AI) and machine learning (ML) offer promising solutions that could accelerate the discovery and optimization of new antivirals. Motivated by this, in this paper, we present an extensive survey on the application of AI and ML for combating COVID-19 based on the rapidly emerging literature. Particularly, we point out the challenges and future directions associated with state-of-the-art solutions to effectively control the COVID-19 pandemic. We hope that this review provides researchers with new insights into the ways AI and ML fight and have fought the COVID-19 outbreak.
Insights
Artificial intelligence (AI) and machine learning (ML) can accelerate the discovery of new antivirals to combat coronavirus disease 2019 (COVID-19). This review surveys AI and ML applications, challenges, and future directions for controlling the COVID-19 pandemic.
Area of Science:
- * Infectious Diseases and Virology
- * Computational Biology and Bioinformatics
- * Artificial Intelligence and Machine Learning
Background:
- * The COVID-19 pandemic, caused by SARS-CoV-2, has resulted in significant global mortality.
- * Developing effective drugs and vaccines for SARS-CoV-2 is a time-consuming process.
- * Artificial intelligence (AI) and machine learning (ML) present potential avenues to expedite antiviral development.
Purpose of the Study:
- * To provide a comprehensive survey of AI and ML applications in combating COVID-19.
- * To analyze the challenges and future directions of AI/ML-driven solutions against the pandemic.
- * To offer insights for researchers on the role of AI and ML in fighting the COVID-19 outbreak.
Main Methods:
- * Extensive literature review of AI and ML applications for COVID-19.
- * Analysis of existing research on AI/ML in drug discovery and optimization for novel viruses.
- * Identification of current challenges and future research trajectories in the field.
Main Results:
- * AI and ML are being increasingly applied to accelerate the discovery and optimization of antiviral treatments for COVID-19.
- * Various AI/ML methodologies show promise in identifying potential drug candidates and understanding viral mechanisms.
- * The survey highlights the critical role of AI and ML in addressing the urgent need for effective COVID-19 therapeutics.
Conclusions:
- * AI and ML offer powerful tools to accelerate the fight against the COVID-19 pandemic.
- * Continued research and development in AI/ML are crucial for overcoming challenges in antiviral discovery.
- * This review provides a roadmap for leveraging AI and ML to combat current and future viral outbreaks.
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