Potential Anti-SARS-CoV-2 Molecular Strategies
Herein we describe some molecular aspects of the recent anti-COVID-19 research, including some approaches making use of natural remedies, especially from medicinal plants, in silico methods, and different experimental procedures that led to the discovery of novel targets of SARS-CoV-2 and consequent...
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| Ձևաչափ: | Online |
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| Լեզու: | անգլերեն |
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MDPI - Multidisciplinary Digital Publishing Institute
2023
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| Խորագրեր: | |
| Առցանց հասանելիություն: | ONIX_20230405_9783036569635_177 |
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Չկան պիտակներ, Եղեք առաջինը, ով նշում է այս գրառումը!
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| _version_ | 1869515431756169216 |
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| collection | Directory of Open Access Books |
| description | Herein we describe some molecular aspects of the recent anti-COVID-19 research, including some approaches making use of natural remedies, especially from medicinal plants, in silico methods, and different experimental procedures that led to the discovery of novel targets of SARS-CoV-2 and consequently novel potential COVID-19 therapeutics. COVID-19 vaccines also find mention in this book with also a description of some adverse effects reported in some cases. Considering that the different beta coronaviruses present certain conserved biomolecular mechanisms and, thus, some common therapeutic targets, finding effective therapies for a specific member of their family (such as SARS-CoV, SARS-CoV-2, and MERS-CoV) even in a scenario of a reduced impact at the time of the related disease on humankind is still relevant as it could offer or inspire efficacious therapeutic strategies not only in the context of novel pathogenic mutations of the already known beta coronaviruses, but also when future zoonoses caused by other beta coronaviruses will emergence, which is not unlikely to occur in the current world where the interactions between humans and wildlife are made more and more frequent due to the growing loss of intact ecosystems worldwide. |
| format | Online |
| id | doab-20.500.12854ir-98898 |
| institution | Directory of Open Access Books |
| language | eng |
| publishDate | 2023 |
| publishDateRange | 2023 |
| publishDateSort | 2023 |
| publisher | MDPI - Multidisciplinary Digital Publishing Institute |
| publisherStr | MDPI - Multidisciplinary Digital Publishing Institute |
| record_format | ojs |
| spelling | doab-20.500.12854ir-988982024-04-11T15:11:10Z Potential Anti-SARS-CoV-2 Molecular Strategies Roviello, Giovanni N. Vicidomini, Caterina coronavirus infections pandemics natural compounds clove Syzygium aromaticum eugenol eugeniin SARS-CoV-2 COVID-19 phytochemicals herbal medicine catechin polyphenol tea leaf extract theaflavin virucidal activity MERS-CoV S1-NTD pharmacophore modeling ADME quantum mechanical calculation DFT FMO MM/GBSA molecular docking Molecular Dynamics Simulation HOMO LUMO COVID-19 vaccine disseminated intravascular coagulation heparin induced thrombocytopenia platelet factor 4 thrombosis thrombotic thrombo-cytopenic purpura vaccine induced thrombocytopenia and thrombosis disinfectants ethanol hand hygiene ozonated water slightly acidic electrolyzed water virucidal mechanism coronavirus renal disease nephrotoxicity reno-protective effect green tea epigallocatechin-3-gallate (EGCG) flavonoids natural products medicinal plant SARS-Cov-2 nsp10 structural similarity fingerprint ADMET toxicity main protease triazole docking MD simulation drug proteomic vaccine immunology biomarker cheminformatics phytocompounds systems pharmacology anti-COVID-19 drug repositioning molecular dynamic simulations binding free energy signal peptide RBD protein secretion mutant nucleocapsid or nucleoprotein structure-based drug discovery alphafold model and molecular dynamics neuroinflammation brain fog neuropeptides neurotransmission metabolism NSAIDs inflammation ketoprofen n/a thema EDItEUR::T Technology, Engineering, Agriculture, Industrial processes::TB Technology: general issues thema EDItEUR::T Technology, Engineering, Agriculture, Industrial processes::TC Biochemical engineering::TCB Biotechnology Herein we describe some molecular aspects of the recent anti-COVID-19 research, including some approaches making use of natural remedies, especially from medicinal plants, in silico methods, and different experimental procedures that led to the discovery of novel targets of SARS-CoV-2 and consequently novel potential COVID-19 therapeutics. COVID-19 vaccines also find mention in this book with also a description of some adverse effects reported in some cases. Considering that the different beta coronaviruses present certain conserved biomolecular mechanisms and, thus, some common therapeutic targets, finding effective therapies for a specific member of their family (such as SARS-CoV, SARS-CoV-2, and MERS-CoV) even in a scenario of a reduced impact at the time of the related disease on humankind is still relevant as it could offer or inspire efficacious therapeutic strategies not only in the context of novel pathogenic mutations of the already known beta coronaviruses, but also when future zoonoses caused by other beta coronaviruses will emergence, which is not unlikely to occur in the current world where the interactions between humans and wildlife are made more and more frequent due to the growing loss of intact ecosystems worldwide. 2023-04-05T12:57:53Z 2023-04-05T12:57:53Z 2023 book ONIX_20230405_9783036569635_177 9783036569635 9783036569628 https://directory.doabooks.org/handle/20.500.12854/98898 eng application/octet-stream Attribution 4.0 International https://mdpi.com/books/pdfview/book/6951 https://mdpi.com/books/pdfview/book/6951 MDPI - Multidisciplinary Digital Publishing Institute 10.3390/books978-3-0365-6962-8 10.3390/books978-3-0365-6962-8 46cabcaa-dd94-4bfe-87b4-55023c1b36d0 9783036569635 9783036569628 254 Basel open access |
| spellingShingle | coronavirus infections pandemics natural compounds clove Syzygium aromaticum eugenol eugeniin SARS-CoV-2 COVID-19 phytochemicals herbal medicine catechin polyphenol tea leaf extract theaflavin virucidal activity MERS-CoV S1-NTD pharmacophore modeling ADME quantum mechanical calculation DFT FMO MM/GBSA molecular docking Molecular Dynamics Simulation HOMO LUMO COVID-19 vaccine disseminated intravascular coagulation heparin induced thrombocytopenia platelet factor 4 thrombosis thrombotic thrombo-cytopenic purpura vaccine induced thrombocytopenia and thrombosis disinfectants ethanol hand hygiene ozonated water slightly acidic electrolyzed water virucidal mechanism coronavirus renal disease nephrotoxicity reno-protective effect green tea epigallocatechin-3-gallate (EGCG) flavonoids natural products medicinal plant SARS-Cov-2 nsp10 structural similarity fingerprint ADMET toxicity main protease triazole docking MD simulation drug proteomic vaccine immunology biomarker cheminformatics phytocompounds systems pharmacology anti-COVID-19 drug repositioning molecular dynamic simulations binding free energy signal peptide RBD protein secretion mutant nucleocapsid or nucleoprotein structure-based drug discovery alphafold model and molecular dynamics neuroinflammation brain fog neuropeptides neurotransmission metabolism NSAIDs inflammation ketoprofen n/a thema EDItEUR::T Technology, Engineering, Agriculture, Industrial processes::TB Technology: general issues thema EDItEUR::T Technology, Engineering, Agriculture, Industrial processes::TC Biochemical engineering::TCB Biotechnology Potential Anti-SARS-CoV-2 Molecular Strategies |
| title | Potential Anti-SARS-CoV-2 Molecular Strategies |
| title_full | Potential Anti-SARS-CoV-2 Molecular Strategies |
| title_fullStr | Potential Anti-SARS-CoV-2 Molecular Strategies |
| title_full_unstemmed | Potential Anti-SARS-CoV-2 Molecular Strategies |
| title_short | Potential Anti-SARS-CoV-2 Molecular Strategies |
| title_sort | potential anti sars cov 2 molecular strategies |
| topic | coronavirus infections pandemics natural compounds clove Syzygium aromaticum eugenol eugeniin SARS-CoV-2 COVID-19 phytochemicals herbal medicine catechin polyphenol tea leaf extract theaflavin virucidal activity MERS-CoV S1-NTD pharmacophore modeling ADME quantum mechanical calculation DFT FMO MM/GBSA molecular docking Molecular Dynamics Simulation HOMO LUMO COVID-19 vaccine disseminated intravascular coagulation heparin induced thrombocytopenia platelet factor 4 thrombosis thrombotic thrombo-cytopenic purpura vaccine induced thrombocytopenia and thrombosis disinfectants ethanol hand hygiene ozonated water slightly acidic electrolyzed water virucidal mechanism coronavirus renal disease nephrotoxicity reno-protective effect green tea epigallocatechin-3-gallate (EGCG) flavonoids natural products medicinal plant SARS-Cov-2 nsp10 structural similarity fingerprint ADMET toxicity main protease triazole docking MD simulation drug proteomic vaccine immunology biomarker cheminformatics phytocompounds systems pharmacology anti-COVID-19 drug repositioning molecular dynamic simulations binding free energy signal peptide RBD protein secretion mutant nucleocapsid or nucleoprotein structure-based drug discovery alphafold model and molecular dynamics neuroinflammation brain fog neuropeptides neurotransmission metabolism NSAIDs inflammation ketoprofen n/a thema EDItEUR::T Technology, Engineering, Agriculture, Industrial processes::TB Technology: general issues thema EDItEUR::T Technology, Engineering, Agriculture, Industrial processes::TC Biochemical engineering::TCB Biotechnology |
| topic_facet | coronavirus infections pandemics natural compounds clove Syzygium aromaticum eugenol eugeniin SARS-CoV-2 COVID-19 phytochemicals herbal medicine catechin polyphenol tea leaf extract theaflavin virucidal activity MERS-CoV S1-NTD pharmacophore modeling ADME quantum mechanical calculation DFT FMO MM/GBSA molecular docking Molecular Dynamics Simulation HOMO LUMO COVID-19 vaccine disseminated intravascular coagulation heparin induced thrombocytopenia platelet factor 4 thrombosis thrombotic thrombo-cytopenic purpura vaccine induced thrombocytopenia and thrombosis disinfectants ethanol hand hygiene ozonated water slightly acidic electrolyzed water virucidal mechanism coronavirus renal disease nephrotoxicity reno-protective effect green tea epigallocatechin-3-gallate (EGCG) flavonoids natural products medicinal plant SARS-Cov-2 nsp10 structural similarity fingerprint ADMET toxicity main protease triazole docking MD simulation drug proteomic vaccine immunology biomarker cheminformatics phytocompounds systems pharmacology anti-COVID-19 drug repositioning molecular dynamic simulations binding free energy signal peptide RBD protein secretion mutant nucleocapsid or nucleoprotein structure-based drug discovery alphafold model and molecular dynamics neuroinflammation brain fog neuropeptides neurotransmission metabolism NSAIDs inflammation ketoprofen n/a thema EDItEUR::T Technology, Engineering, Agriculture, Industrial processes::TB Technology: general issues thema EDItEUR::T Technology, Engineering, Agriculture, Industrial processes::TC Biochemical engineering::TCB Biotechnology |
| url | ONIX_20230405_9783036569635_177 |