The Journal of Pharmaceutical Sciences and Drug Research (JPSD) is dedicated to showcasing transformative research that pushes the boundaries of drug discovery and development. One of the most rapidly evolving and impactful areas within pharmaceutical sciences is advanced computational drug design, which has revolutionized the way scientists identify, optimize, and develop new therapeutic candidates. With the rising complexity of diseases, the increasing cost of research and development, and the urgent global demand for faster, safer, and more effective medicines, computational approaches have emerged as indispensable tools for modern drug discovery. By combining powerful algorithms, high-performance computing, artificial intelligence (AI), and data-driven modeling, researchers can now accelerate the drug discovery process, reduce costs, and enhance precision in ways that were unimaginable just a decade ago.