Interestingly, Z-ajoene showed the lowest binding energy of -5.07 kcal/mol and inhibition constant of 192.57µM. However, the binding energy and inhibition constant of all nine phytoconstituents were determined. Results: Five out of 9 phytoconstituents were found to form conventional hydrogen bonds, and only alliin formed the highest number of hydrogen bonds. Method: Auto Dock was used to evaluate selected garlic phytochemical molecules against 1,3-beta-glucan synthase fungal protein, and Discovery studio visualizer was used to create 3D and 2D interaction photos. Thus, the objective of the study was to check the potency of garlic phytoconstituents against the 1,3-beta-glucan synthase fungal protein using in-silico methods. Objective: Garlic phytoconstituents have shown remarkable antifungal properties against various fungal species in various studies. In addition, no specific medication against mucormycosis/black fungus makes things even worse. However, its association and rising cases of mucormycosis, also known as black fungus make the scenario even more troublesome. Background: The COVID-19 pandemic is a major concern.
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