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. 2021 Feb 22;11(2):329. doi: 10.3390/biom11020329
ADMET Absorption, Distribution, Metabolism, Excretion and Toxicity
FRED Fast Rigid Exhaustive Docking
MD Simulation Molecular Dynamics Simulation
MM-PBSA Molecular Mechanics: Poisson Boltzmann Surface Area
MOE Molecular Operating Environment
MVD Molegro Virtual Docker
NAMD Nanoscale Molecular Dynamics
TNF-α Tumor Necrosis Factor-α
TNFR Tumor Necrosis Factor-α Receptor
VS Virtual Screening
ZINC Zinc Is Not Commercial