Validation Studies of the Site-Directed Docking Program LibDock
Rao, Shashidhar N, Head, Martha S, Kulkarni, Amit, LaLonde, Judith M
Published in Journal of chemical information and modeling (01.11.2007)
Published in Journal of chemical information and modeling (01.11.2007)
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Structure-Based Design, Synthesis and Validation of CD4-Mimetic Small Molecule Inhibitors of HIV‑1 Entry: Conversion of a Viral Entry Agonist to an Antagonist
Courter, Joel R, Madani, Navid, Sodroski, Joseph, Schön, Arne, Freire, Ernesto, Kwong, Peter D, Hendrickson, Wayne A, Chaiken, Irwin M, LaLonde, Judith M, Smith, Amos B
Published in Accounts of chemical research (15.04.2014)
Published in Accounts of chemical research (15.04.2014)
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Indoleamine 2,3-Dioxygenase Is the Anticancer Target for a Novel Series of Potent Naphthoquinone-Based Inhibitors
Kumar, Sanjeev, Malachowski, William P, DuHadaway, James B, LaLonde, Judith M, Carroll, Patrick J, Jaller, Daniel, Metz, Richard, Prendergast, George C, Muller, Alexander J
Published in Journal of medicinal chemistry (27.03.2008)
Published in Journal of medicinal chemistry (27.03.2008)
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Structure-Based Design, Synthesis, and Characterization of Dual Hotspot Small-Molecule HIV-1 Entry Inhibitors
LaLonde, Judith M, Kwon, Young Do, Jones, David M, Sun, Alexander W, Courter, Joel R, Soeta, Takahiro, Kobayashi, Toyoharu, Princiotto, Amy M, Wu, Xueling, Schön, Arne, Freire, Ernesto, Kwong, Peter D, Mascola, John R, Sodroski, Joseph, Madani, Navid, Smith, Amos B
Published in Journal of medicinal chemistry (10.05.2012)
Published in Journal of medicinal chemistry (10.05.2012)
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Journal Article
Small-Molecule CD4-Mimics: Structure-Based Optimization of HIV‑1 Entry Inhibition
Melillo, Bruno, Liang, Shuaiyi, Park, Jongwoo, Schön, Arne, Courter, Joel R, LaLonde, Judith M, Wendler, Daniel J, Princiotto, Amy M, Seaman, Michael S, Freire, Ernesto, Sodroski, Joseph, Madani, Navid, Hendrickson, Wayne A, Smith, Amos B
Published in ACS medicinal chemistry letters (10.03.2016)
Published in ACS medicinal chemistry letters (10.03.2016)
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Journal Article
Crystal structures of HIV-1 gp120 envelope glycoprotein in complex with NBD analogues that target the CD4-binding site
Kwon, Young Do, LaLonde, Judith M, Yang, Yongping, Elban, Mark A, Sugawara, Akihiro, Courter, Joel R, Jones, David M, Smith, 3rd, Amos B, Debnath, Asim K, Kwong, Peter D
Published in PloS one (28.01.2014)
Published in PloS one (28.01.2014)
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Design, synthesis and biological evaluation of small molecule inhibitors of CD4-gp120 binding based on virtual screening
LaLonde, Judith M., Elban, Mark A., Courter, Joel R., Sugawara, Akihiro, Soeta, Takahiro, Madani, Navid, Princiotto, Amy M., Kwon, Young Do, Kwong, Peter D., Schön, Arne, Freire, Ernesto, Sodroski, Joseph, Smith, Amos B.
Published in Bioorganic & medicinal chemistry (01.01.2011)
Published in Bioorganic & medicinal chemistry (01.01.2011)
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Spontaneous Rearrangement of the β20/β21 Strands in Simulations of Unliganded HIV‑1 Glycoprotein, gp120
Shrivastava, Indira H, Wendel, Kaylee, LaLonde, Judith M
Published in Biochemistry (Easton) (02.10.2012)
Published in Biochemistry (Easton) (02.10.2012)
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A Model of Peptide Triazole Entry Inhibitor Binding to HIV‑1 gp120 and the Mechanism of Bridging Sheet Disruption
Emileh, Ali, Tuzer, Ferit, Yeh, Herman, Umashankara, Muddegowda, Moreira, Diogo R. M, LaLonde, Judith M, Bewley, Carole A, Abrams, Cameron F, Chaiken, Irwin M
Published in Biochemistry (Easton) (02.04.2013)
Published in Biochemistry (Easton) (02.04.2013)
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Structure-Based Design and Synthesis of an HIV‑1 Entry Inhibitor Exploiting X‑ray and Thermodynamic Characterization
LaLonde, Judith M., Le-Khac, Matthew, Jones, David M., Courter, Joel R., Park, Jongwoo, Schön, Arne, Princiotto, Amy M., Wu, Xueling, Mascola, John R., Freire, Ernesto, Sodroski, Joseph, Madani, Navid, Hendrickson, Wayne A., Smith, Amos B.
Published in ACS medicinal chemistry letters (14.03.2013)
Published in ACS medicinal chemistry letters (14.03.2013)
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Journal Article
Structure Based Development of Phenylimidazole-Derived Inhibitors of Indoleamine 2,3-Dioxygenase
Kumar, Sanjeev, Jaller, Daniel, Patel, Bhumika, LaLonde, Judith M, DuHadaway, James B, Malachowski, William P, Prendergast, George C, Muller, Alexander J
Published in Journal of medicinal chemistry (28.08.2008)
Published in Journal of medicinal chemistry (28.08.2008)
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O-alkylhydroxylamines as rationally-designed mechanism-based inhibitors of indoleamine 2,3-dioxygenase-1
Malachowski, William P., Winters, Maria, DuHadaway, James B., Lewis-Ballester, Ariel, Badir, Shorouk, Wai, Jenny, Rahman, Maisha, Sheikh, Eesha, LaLonde, Judith M., Yeh, Syun-Ru, Prendergast, George C., Muller, Alexander J.
Published in European journal of medicinal chemistry (27.01.2016)
Published in European journal of medicinal chemistry (27.01.2016)
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Journal Article
Indoleamine 2,3-Dioxygenase Is the Anticancer Target for a Novel Series of Potent Naphthoquinone-Based Inhibitors
Kumar, Sanjeev, Malachowski, William P, DuHadaway, James B, LaLonde, Judith M, Carroll, Patrick J, Jaller, Daniel, Metz, Richard, Prendergast, George C, Muller, Alexander J
Published in Journal of medicinal chemistry (27.11.2008)
Published in Journal of medicinal chemistry (27.11.2008)
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Journal Article
Small-Molecule CD4 Mimics Interact with a Highly Conserved Pocket on HIV-1 gp120
Madani, Navid, Schön, Arne, Princiotto, Amy M., LaLonde, Judith M., Courter, Joel R., Soeta, Takahiro, Ng, Danny, Wang, Liping, Brower, Evan T., Xiang, Shi-Hua, Do Kwon, Young, Huang, Chih-chin, Wyatt, Richard, Kwong, Peter D., Freire, Ernesto, Smith, Amos B., Sodroski, Joseph
Published in Structure (London) (12.11.2008)
Published in Structure (London) (12.11.2008)
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Some Binding-Related Drug Properties are Dependent on Thermodynamic Signature
Schön, Arne, Madani, Navid, Smith, Amos B, Lalonde, Judith M, Freire, Ernesto
Published in Chemical biology & drug design (01.03.2011)
Published in Chemical biology & drug design (01.03.2011)
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Journal Article
Structure-Based Identification and Neutralization Mechanism of Tyrosine Sulfate Mimetics That Inhibit HIV-1 Entry
Acharya, Priyamvada, Dogo-Isonagie, Cajetan, LaLonde, Judith M, Lam, Son N, Leslie, George J, Louder, Mark K, Frye, Leah L, Debnath, Asim K, Greenwood, Jeremy R, Luongo, Timothy S, Martin, Loïc, Watts, K. Shawn, Hoxie, James A, Mascola, John R, Bewley, Carole A, Kwong, Peter D
Published in ACS chemical biology (21.10.2011)
Published in ACS chemical biology (21.10.2011)
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