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- W4304789163 abstract "Emerging infectious diseases (EID) as well as reappearing irresistible infections are expanding worldwide. Utmost of similar cases, it was seen that the EIDs have long been perceived as a predominant conclusion of host-pathogen adaption. Here, one should get to analyze their host-pathogen interlink and their by needs to look ways, as an example, by exploitation process methodology particularly molecular docking and molecular dynamics simulation, have been utilized in recent time as the most outstanding tools. Hence, we have overviewed some of important factors that influences on EIDs especially HIV/AIDs, H1N1 and coronavirus. Moreover, here we specified the importance of molecular docking applications especially molecular dynamics simulations approach to determine novel compounds on the emerging infectious diseases. Additionally, in vivo and in vitro studies approach to determine novel compounds on the emerging infectious diseases that has implemented to evaluate the limiting affinities between small particles as well as macromolecule that can further, used as a target of HIV/AIDs, H1N1, and coronavirus were also discussed. These novel drug molecules approved in vivo and in vitro studies with reaffirm results and hence, it is clear that the computational methods (mainly molecular docking and molecular dynamics) are found to be more effective technique for drug discovery and medical practitioners. • Emerging infectious diseases (EIDs) are among the major problems impacted on global economics and health. • Few key factors that influences on EIDs especially HIV/AIDs, H1N1 and coronavirus were overviewed. • MD simulations approach to understand novel compounds with emerging infectious diseases are discussed." @default.
- W4304789163 created "2022-10-13" @default.
- W4304789163 creator A5001662637 @default.
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- W4304789163 date "2022-10-01" @default.
- W4304789163 modified "2023-09-27" @default.
- W4304789163 title "WITHDRAWN: Molecular docking used as an advanced tool to determine novel compounds on emerging infectious diseases: A systematic review" @default.
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- W4304789163 doi "https://doi.org/10.1016/j.pbiomolbio.2022.10.001" @default.
- W4304789163 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/36240897" @default.
- W4304789163 hasPublicationYear "2022" @default.