Combination of QSAR, molecular docking, molecular dynamic simulation and MM-PBSA: analogues of lopinavir and favipiravir as potential drug candidates against COVID-19
结合QSAR、分子对接、分子动力学模拟和MM-PBSA:洛匹那韦和法匹拉韦类似物作为抗COVID-19的潜在候选药物
期刊:Journal of Biomolecular Structure & Dynamics
影响因子:2.4
doi:10.1080/07391102.2020.1850355
Rafi, Md Oliullah; Bhattacharje, Gourab; Al-Khafaji, Khattab; Taskin-Tok, Tugba; Alfasane, Md Almujaddade; Das, Amit Kumar; Parvez, Md Anowar Khasru; Rahman, Md Shahedur