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Essential Oils and monoterpene binary mixtures as organic bioinsecticides against Callosobruchus maculatus: Bioassay, molecular docking, and dynamics insights
EO-based biofumigants for post-harvest protection of organic pulses support EO-based biofumigants for post-harvest protection of organic pulses, and males were more sensitive than females.
Multi-Target Bioactivity of Dittrichia viscosa Polyphenols: HPLC-ESI-MS Profiling, Antimicrobial Mechanisms, and Molecular Docking
D. viscosa is a promising source of bioactive phenolics for pharmaceutical and agrochemical development and is a promising source of bioactive phenolics for pharmaceutical and agrochemical development.
Integrated Computational Study Prioritizes Drug-like Para-Flavonoids as Candidate SARS-CoV-2 Mpro Inhibitors
Seven para-substituted flavonoid hybrids against the main protease (Mpro) are designed and M6 is prioritized as a computational lead requiring Mpro inhibition, antiviral, and cytotoxicity validation.