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The last 5 uploaded publications
Computationally-Guided Optimization of a Docking Hit to Yield Catechol Diethers as Potent Anti-HIV Agents
Mariela Bollini, Robert A. Domaoal, Vinay V. Thakur, Ricardo Gallardo‐Macias, Krasimir A. Spasov, Karen S. Anderson, William L. Jorgensen (2011). Computationally-Guided Optimization of a Docking Hit to Yield Catechol Diethers as Potent Anti-HIV Agents. Journal of Medicinal Chemistry, 54(24), pp. 8582-8591, DOI: 10.1021/jm201134m.
Article359 days agoOptimization of Azoles as Anti-Human Immunodeficiency Virus Agents Guided by Free-Energy Calculations
Jacob G. Zeevaart, Ligong Wang, Vinay V. Thakur, Cheryl S. Leung, Julian Tirado‐Rives, Christopher M. Bailey, Robert A. Domaoal, Karen S. Anderson, William L. Jorgensen (2008). Optimization of Azoles as Anti-Human Immunodeficiency Virus Agents Guided by Free-Energy Calculations. Journal of the American Chemical Society, 130(29), pp. 9492-9499, DOI: 10.1021/ja8019214.
Article359 days agoEfficient Discovery of Potent Anti-HIV Agents Targeting the Tyr181Cys Variant of HIV Reverse Transcriptase
William L. Jorgensen, Mariela Bollini, Vinay V. Thakur, Robert A. Domaoal, Krasimir A. Spasov, Karen S. Anderson (2011). Efficient Discovery of Potent Anti-HIV Agents Targeting the Tyr181Cys Variant of HIV Reverse Transcriptase. Journal of the American Chemical Society, 133(39), pp. 15686-15696, DOI: 10.1021/ja2058583.
Article359 days agoFrom Docking False-Positive to Active Anti-HIV Agent
Gabriela Barreiro, Joseph T. Kim, Cristiano R. W. Guimarães, Christopher M. Bailey, Robert A. Domaoal, Ligong Wang, Karen S. Anderson, William L. Jorgensen (2007). From Docking False-Positive to Active Anti-HIV Agent. Journal of Medicinal Chemistry, 50(22), pp. 5324-5329, DOI: 10.1021/jm070683u.
Article359 days agoOptimization of pyrimidinyl- and triazinyl-amines as non-nucleoside inhibitors of HIV-1 reverse transcriptase
Vinay V. Thakur, Joseph T. Kim, Andrew D. Hamilton, Christopher M. Bailey, Robert A. Domaoal, Ligong Wang, Karen S. Anderson, William L. Jorgensen (2006). Optimization of pyrimidinyl- and triazinyl-amines as non-nucleoside inhibitors of HIV-1 reverse transcriptase. Bioorganic & Medicinal Chemistry Letters, 16(21), pp. 5664-5667, DOI: 10.1016/j.bmcl.2006.08.037.
Article359 days ago