Artificial Intelligence and Molecular Docking Focus on Selected Methods
Abstract
Artificial intelligence (AI) has emerged as a powerful tool in drug discovery and development, revolutionizing the field of molecular docking. This review provides an overview of current approaches in molecular docking using AI techniques, including machine learning and deep learning algorithms. We discuss the application of AI in virtual screening, ligand-receptor binding prediction, and drug optimization, highlighting recent advancements, challenges, and future directions.
Keywords: Artificial intelligence, molecular docking, virtual screening, drug discovery, machine learning, deep learning.
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