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Öğe Exploring physico-chemical properties of HIV/AIDS drugs using neighborhood topological indices of molecular graphs(Springer, 2024) Yasin, Faisal; Afzal, Zeeshan; Chaudhary, Faryal; Akgul, Ali; Hassan, Ahmad M.; Karamat, MuhammadIn this study, we investigate the efficacy of neighborhood-degree-based topological indices in the modeling of drug properties pertinent to HIV/AIDS. By representing molecular structures as graphs, we delve deep into atom-level environments, uncovering intricate relationships between local topological attributes and theoretical characteristics. Through meticulous quantitative structure-property relationship analysis, we establish robust correlations between these indices and drug properties. This breakthrough augurs predictive insights in the realm of pharmaceutical research, reducing the need for exhaustive experimentation. Our research underscores the pivotal role played by neighborhood-degree-based topological indices in advancing drug discovery, offering a powerful tool that resonates with chemists and industry professionals. It marks a transformative step in the trajectory of pharmaceutical development, promising to redefine and enhance the future of drug design and innovation.Öğe Neuro-computing solution for Lorenz differential equations through artificial neural networks integrated with PSO-NNA hybrid meta-heuristic algorithms: a comparative study(Nature Portfolio, 2024) Aslam, Muhammad Naeem; Aslam, Muhammad Waheed; Arshad, Muhammad Sarmad; Afzal, Zeeshan; Hassani, Murad Khan; Zidan, Ahmed M.; Akgul, AliIn this article, examine the performance of a physics informed neural networks (PINN) intelligent approach for predicting the solution of non-linear Lorenz differential equations. The main focus resides in the realm of leveraging unsupervised machine learning for the prediction of the Lorenz differential equation associated particle swarm optimization (PSO) hybridization with the neural networks algorithm (NNA) as ANN-PSO-NNA. In particular embark on a comprehensive comparative analysis employing the Lorenz differential equation for proposed approach as test case. The nonlinear Lorenz differential equations stand as a quintessential chaotic system, widely utilized in scientific investigations and behavior of dynamics system. The validation of physics informed neural network (PINN) methodology expands to via multiple independent runs, allowing evaluating the performance of the proposed ANN-PSO-NNA algorithms. Additionally, explore into a comprehensive statistical analysis inclusive metrics including minimum (min), maximum (max), average, standard deviation (S.D) values, and mean squared error (MSE). This evaluation provides found observation into the adeptness of proposed AN-PSO-NNA hybridization approach across multiple runs, ultimately improving the understanding of its utility and efficiency.