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ADME/T, absorption, distribution, metabolism, excretion and toxicity
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COVID-19
1
COVID-19, Coronavirus disease 2019
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Combination drug therapy
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Computer simulation
1
Computers molecular
1
H-bonds, hydrogen bonds
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Journal Article
1
LD50, median lethal dose
1
MD, molecular dynamics
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MM-PBSA, molecular mechanics Poisson Boltzmann surface area
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Mpro, main protease
1
Natural products
1
PAINS, Pan-assay interference compounds
1
RCO, inter-residue contact order
1
RMSF, root-mean-square-fluctuation
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SARS-CoV-2, severe acute respiratory syndrome coronavirus 2
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SMILES, Simplified Molecular-input Line-entry System
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TCMSP, traditional Chinese medicine systems pharmacology database and analysis platform
1
TQG, Toujie Quwen Granule
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Virus diseases
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