Modelling the DFT structural and reactivity study of feverfew and evaluation of its potential antiviral activity against COVID-19 using molecular docking and MD simulations
利用分子对接和分子动力学模拟对小白菊进行DFT结构和反应性研究,并评估其对COVID-19的潜在抗病毒活性
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doi:10.1007/s11696-022-02067-6
Lakhera, Shradha; Devlal, Kamal; Ghosh, Arabinda; Chowdhury, Papia; Rana, Meenakshi