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• Reckoning γ-Glutamyl-S-allylcysteine as a potential main protease (m^pro) inhibitor of novel SARS-CoV-2 virus identified using docking and molecular dynamics simulation.

  Parashar A, Shukla A, Sharma A, Behl T, Goswami D, Mehta V. Parashar A, et al. Drug Dev Ind Pharm. 2021 May;47(5):699-710. doi: 10.1080/03639045.2021.1934857. Epub 2021 Jun 7. Drug Dev Ind Pharm. 2021. PMID: 34038246 Free PMC article.
• Discovery, synthesis, and structure-based optimization of a series of N-(tert-butyl)-2-(N-arylamido)-2-(pyridin-3-yl) acetamides (ML188) as potent noncovalent small molecule inhibitors of the severe acute respiratory syndrome coronavirus (SARS-CoV) 3CL protease.

  Jacobs J, Grum-Tokars V, Zhou Y, Turlington M, Saldanha SA, Chase P, Eggler A, Dawson ES, Baez-Santos YM, Tomar S, Mielech AM, Baker SC, Lindsley CW, Hodder P, Mesecar A, Stauffer SR. Jacobs J, et al. J Med Chem. 2013 Jan 24;56(2):534-46. doi: 10.1021/jm301580n. Epub 2013 Jan 3. J Med Chem. 2013. PMID: 23231439 Free PMC article.
• Finding the sweet spot: the role of nature and nurture in medicinal chemistry.

  Hann MM, Keserü GM. Hann MM, et al. Nat Rev Drug Discov. 2012 Apr 30;11(5):355-65. doi: 10.1038/nrd3701. Nat Rev Drug Discov. 2012. PMID: 22543468 Review.
• Application of fragment-based drug discovery to membrane proteins: identification of ligands of the integral membrane enzyme DsbB.

  Früh V, Zhou Y, Chen D, Loch C, Ab E, Grinkova YN, Verheij H, Sligar SG, Bushweller JH, Siegal G. Früh V, et al. Chem Biol. 2010 Aug 27;17(8):881-91. doi: 10.1016/j.chembiol.2010.06.011. Chem Biol. 2010. PMID: 20797617 Free PMC article.
• Selective orthosteric free fatty acid receptor 2 (FFA2) agonists: identification of the structural and chemical requirements for selective activation of FFA2 versus FFA3.

  Schmidt J, Smith NJ, Christiansen E, Tikhonova IG, Grundmann M, Hudson BD, Ward RJ, Drewke C, Milligan G, Kostenis E, Ulven T. Schmidt J, et al. J Biol Chem. 2011 Mar 25;286(12):10628-40. doi: 10.1074/jbc.M110.210872. Epub 2011 Jan 10. J Biol Chem. 2011. PMID: 21220428 Free PMC article.