Exploration into the Antibacterial Attributes of Medicinal Plants In Vitro Examinations ADMET Prediction Molecular Docking Analysis and Molecular Dynamics simulation.

Abstract

The graduation thesis “Exploring the antibacterial properties of medicinal plants” aims to study the antibacterial potential of compounds extracted from medicinal plants. Laboratory assays have been performed to evaluate antibacterial activity against important species such as Staphylococcus aureus, Klebsiella pneumoniae, Escherichia coli, and Bacillus subtilis. The Reviews of Drugs and Bioscenarios (ADMET) included analysis of the distribution, absorption and druggability of plant compounds. Molecular binding analysis and molecular dynamics simulations have also been used to understand the molecular interactions between compounds and bacteria. The results showed the strong potential of plant compounds to combat bacteria, suggesting they could be used as a natural alternative to traditional antibiotics. Further research is recommended to determine the exact mechanisms of this effectiveness and to develop new treatments to combat bacterial infections.