Pinpointing the potential hits for hindering interaction of SARS-CoV-2 S-protein with ACE2 from the pool of antiviral phytochemicals utilizing molecular docking and molecular dynamics (MD) simulations
利用分子对接和分子动力学（MD）模拟，从抗病毒植物化学物质库中确定能够阻碍SARS-CoV-2 S蛋白与ACE2相互作用的潜在活性化合物
期刊:Journal of Molecular Graphics & Modelling
影响因子:3
doi:10.1016/j.jmgm.2021.107874
Patel, Chirag N; Goswami, Dweipayan; Jaiswal, Dharmesh G; Parmar, Robin M; Solanki, Hitesh A; Pandya, Himanshu A
