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10.1080/07391102.2021.1905549 http://scihub22266oqcxt.onion/10.1080/07391102.2021.1905549 33784944!8022343!33784944     free     free     free Deprecated: Implicit conversion from float 233.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 233.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 233.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 233.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 233.6 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 267.2 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 267.2 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534 Deprecated: Implicit conversion from float 267.2 to int loses precision in C:\Inetpub\vhosts\kidney.de\httpdocs\pget.php on line 534       J+Biomol+Struct+Dyn 2022 ; 40 (17): 7940-7948 Nephropedia Template TP {{tp|p=33784944|t=2022. Design and synthesis of novel phe-phe hydroxyethylene derivatives as potential coronavirus main protease inhibitors |pdf=|usr=}}{{33784944}} gab.com Text Design and synthesis of novel phe-phe hydroxyethylene derivatives as potential coronavirus main protease inhibitors JO: J Biomol Struct Dyn http://www.kidney.de/pget.php?&tw=1&pmid=33784944 #FOAvip In response to the current pandemic caused by the novel SARS-CoV-2, we design new compounds based on Lopinavir structure as an FDA-approved antiviral agent which is currently under more evaluation in clinical trials for COVID-19 patients. This is the first example of the preparation of Lopinavir isosteres from the main core of Lopinavir conducted to various heterocyclic fragments. It is proposed that main protease inhibitors play an important role in the cycle life of coronavirus. Thus, the protease inhibition effect of synthesized compounds was studied by molecular docking method. All of these 10 molecules, showing a good docking score compared. Molecular dynamics (MD) simulations also confirmed the stability of the best-designed compound in Mpro active site.Communicated by Ramaswamy H. Sarma. Twit Text FOAVip Design and synthesis of novel phe-phe hydroxyethylene derivatives as potential coronavirus main protease inhibitors ????J Biomol Struct Dyn http://www.kidney.de/pget.php?&tw=1&pmid=33784944 #FOAvip Twit Text # Free Paper on # # # # # LINK http://www.kidney.de/pget.php?&tw=1&pmid=33784944 #FOAvip English Wikipedia <ref>{{Cite pmid|33784944}}</ref> Design and synthesis of novel phe-phe hydroxyethylene derivatives as potential coronavirus main protease inhibitors #MMPMID33784944 Khorsandi Z; Afshinpour M; Molaei F; Askandar RH; Keshavarzipour F; Abbasi M; Sadeghi-Aliabadi H J Biomol Struct Dyn 2022[Oct]; 40 (17): 7940-7948 PMID33784944show ga In response to the current pandemic caused by the novel SARS-CoV-2, we design new compounds based on Lopinavir structure as an FDA-approved antiviral agent which is currently under more evaluation in clinical trials for COVID-19 patients. This is the first example of the preparation of Lopinavir isosteres from the main core of Lopinavir conducted to various heterocyclic fragments. It is proposed that main protease inhibitors play an important role in the cycle life of coronavirus. Thus, the protease inhibition effect of synthesized compounds was studied by molecular docking method. All of these 10 molecules, showing a good docking score compared. Molecular dynamics (MD) simulations also confirmed the stability of the best-designed compound in Mpro active site.Communicated by Ramaswamy H. Sarma. |*COVID-19 Drug Treatment[MESH] |*SARS-CoV-2[MESH] |Antiviral Agents/chemistry/pharmacology[MESH] |Coronavirus 3C Proteases[MESH] |Coronavirus Protease Inhibitors[MESH] |Cysteine Endopeptidases/chemistry[MESH] |Dipeptides[MESH] |Ethylenes[MESH] |Humans[MESH] |Lopinavir/pharmacology[MESH] |Molecular Docking Simulation[MESH] |Molecular Dynamics Simulation[MESH]Design and synthesis of novel phe-phe hydroxyethylene derivatives as p(epmc).pdf DeepDyve Pubget Overpricing