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10.1016/j.ijantimicag.2020.106012 http://scihub22266oqcxt.onion/10.1016/j.ijantimicag.2020.106012 32389723!7205718!32389723     free     free     free Deprecated: Implicit conversion from float 215.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 215.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 215.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 215.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 215.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 249.2 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534       Int+J+Antimicrob+Agents 2020 ; 56 (2): 106012 Nephropedia Template TP {{tp|p=32389723|t=2020. Computational screening of antagonists against the SARS-CoV-2 (COVID-19) coronavirus by molecular docking |pdf=|usr=}}{{32389723}} gab.com Text Computational screening of antagonists against the SARS-CoV-2 (COVID-19) coronavirus by molecular docking JO: Int J Antimicrob Agents http://www.kidney.de/pget.php?&tw=1&pmid=32389723 #FOAvip In the current spread of novel coronavirus (SARS-CoV-2), antiviral drug discovery is of great importance. AutoDock Vina was used to screen potential drugs by molecular docking with the structural protein and non-structural protein sites of new coronavirus. Ribavirin, a common antiviral drug, remdesivir, chloroquine and luteolin were studied. Honeysuckle is generally believed to have antiviral effects in traditional Chinese medicine. In this study, luteolin (the main flavonoid in honeysuckle) was found to bind with a high affinity to the same sites of the main protease of SARS-CoV-2 as the control molecule. Chloroquine has been proved clinically effective and can bind to the main protease; this may be the antiviral mechanism of this drug. The study was restricted to molecular docking without validation by molecular dynamics simulations. Interactions with the main protease may play a key role in fighting against viruses. Luteolin is a potential antiviral molecule worthy of attention. Twit Text FOAVip Computational screening of antagonists against the SARS-CoV-2 (COVID-19) coronavirus by molecular docking ????Int J Antimicrob Agents http://www.kidney.de/pget.php?&tw=1&pmid=32389723 #FOAvip Twit Text # Free Paper on # # # # # LINK http://www.kidney.de/pget.php?&tw=1&pmid=32389723 #FOAvip English Wikipedia <ref>{{Cite pmid|32389723}}</ref> Computational screening of antagonists against the SARS-CoV-2 (COVID-19) coronavirus by molecular docking #MMPMID32389723 Yu R; Chen L; Lan R; Shen R; Li P Int J Antimicrob Agents 2020[Aug]; 56 (2): 106012 PMID32389723show ga In the current spread of novel coronavirus (SARS-CoV-2), antiviral drug discovery is of great importance. AutoDock Vina was used to screen potential drugs by molecular docking with the structural protein and non-structural protein sites of new coronavirus. Ribavirin, a common antiviral drug, remdesivir, chloroquine and luteolin were studied. Honeysuckle is generally believed to have antiviral effects in traditional Chinese medicine. In this study, luteolin (the main flavonoid in honeysuckle) was found to bind with a high affinity to the same sites of the main protease of SARS-CoV-2 as the control molecule. Chloroquine has been proved clinically effective and can bind to the main protease; this may be the antiviral mechanism of this drug. The study was restricted to molecular docking without validation by molecular dynamics simulations. Interactions with the main protease may play a key role in fighting against viruses. Luteolin is a potential antiviral molecule worthy of attention. |*Computational Biology[MESH] |Antiviral Agents/chemistry/*pharmacology[MESH] |Betacoronavirus/*drug effects[MESH] |COVID-19[MESH] |Chloroquine/metabolism/*pharmacology[MESH] |Coronavirus Infections/*virology[MESH] |Humans[MESH] |Luteolin/metabolism/*pharmacology[MESH] |Molecular Docking Simulation[MESH] |Pandemics[MESH] |Pneumonia, Viral/*virology[MESH]Computational screening of antagonists against the SARS-CoV-2 (COVID-1(epmc).pdf DeepDyve Pubget Overpricing