Inhibitor Bound Dengue NS2B-NS3pro Reveals Multiple Dynamic Binding Modes
Gibbs, Alan C, Steele, Ruth, Liu, Gaohua, Tounge, Brett A, Montelione, Gaetano T
Published in Biochemistry (Easton) (13.03.2018)
Published in Biochemistry (Easton) (13.03.2018)
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Journal Article
Fusion to a highly stable consensus albumin binding domain allows for tunable pharmacokinetics
Jacobs, Steven A., Gibbs, Alan C., Conk, Michelle, Yi, Fang, Maguire, Diane, Kane, Colleen, O'Neil, Karyn T.
Published in Protein engineering, design and selection (01.10.2015)
Published in Protein engineering, design and selection (01.10.2015)
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Journal Article
Conformational Sampling of Bioactive Molecules: A Comparative Study
Agrafiotis, Dimitris K, Gibbs, Alan C, Zhu, Fangqiang, Izrailev, Sergei, Martin, Eric
Published in Journal of chemical information and modeling (01.05.2007)
Published in Journal of chemical information and modeling (01.05.2007)
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Journal Article
Comparison of Automated Docking Programs as Virtual Screening Tools
Cummings, Maxwell D, DesJarlais, Renee L, Gibbs, Alan C, Mohan, Venkatraman, Jaeger, Edward P
Published in Journal of medicinal chemistry (24.02.2005)
Published in Journal of medicinal chemistry (24.02.2005)
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Journal Article
Discovery of novel potent imidazo[1,2-b]pyridazine PDE10a inhibitors
Meegalla, Sanath K., Huang, Hui, Illig, Carl R., Parks, Daniel J., Chen, Jinsheng, Lee, Yu-Kai, Wilson, Kenneth J., Patel, Sharmila K., Cheung, Wing S., Lu, Tianbao, Kirchner, Thomas, Askari, Hossein B., Geisler, John, Patch, Raymond J., Gibbs, Alan C., Rady, Brian, Connelly, Margery, Player, Mark R.
Published in Bioorganic & medicinal chemistry letters (01.09.2016)
Published in Bioorganic & medicinal chemistry letters (01.09.2016)
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Journal Article
Docking: Successes and Challenges
Mohan, Venkatraman, Gibbs, Alan C, Cummings, Maxwell D, Jaeger, Edward P, DesJarlais, Renee L
Published in Current pharmaceutical design (01.02.2005)
Published in Current pharmaceutical design (01.02.2005)
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Journal Article
Design, Synthesis, and Biological Evaluation of (2R,αS)-3,4-Dihydro-2-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-5-[3-(trifluoromethoxy)-phenyl]-α-(trifluoromethyl)-1(2H)-quinolineethanol as Potent and Orally Active Cholesteryl Ester Transfer Protein Inhibitor
Kuo, Gee-Hong, Rano, Thomas, Pelton, Patricia, Demarest, Keith T, Gibbs, Alan C, Murray, William V, Damiano, Bruce P, Connelly, Margery A
Published in Journal of medicinal chemistry (26.03.2009)
Published in Journal of medicinal chemistry (26.03.2009)
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Journal Article
Optimization of a pyrazole hit from FBDD into a novel series of indazoles as ketohexokinase inhibitors
Zhang, Xuqing, Song, Fengbing, Kuo, Gee-Hong, Xiang, Amy, Gibbs, Alan C., Abad, Marta C., Sun, Weimei, Kuo, Lawrence C., Sui, Zhihua
Published in Bioorganic & medicinal chemistry letters (15.08.2011)
Published in Bioorganic & medicinal chemistry letters (15.08.2011)
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Journal Article
Electron Density Guided Fragment-Based Lead Discovery of Ketohexokinase Inhibitors
Gibbs, Alan C, Abad, Marta C, Zhang, Xuqing, Tounge, Brett A, Lewandowski, Francis A, Struble, Geoffrey T, Sun, Weimei, Sui, Zhihua, Kuo, Lawrence C
Published in Journal of medicinal chemistry (25.11.2010)
Published in Journal of medicinal chemistry (25.11.2010)
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Journal Article
Quantum Mechanical Pairwise Decomposition Analysis of Protein Kinase B Inhibitors: Validating a New Tool for Guiding Drug Design
Zhang, Xiaohua, Gibbs, Alan C, Reynolds, Charles H, Peters, Martin B, Westerhoff, Lance M
Published in Journal of chemical information and modeling (26.04.2010)
Published in Journal of chemical information and modeling (26.04.2010)
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Journal Article
Pyrimidinopyrimidine inhibitors of ketohexokinase: Exploring the ring C2 group that interacts with Asp-27B in the ligand binding pocket
Maryanoff, Bruce E., O’Neill, John C., McComsey, David F., Yabut, Stephen C., Luci, Diane K., Gibbs, Alan C., Connelly, Margery A.
Published in Bioorganic & medicinal chemistry letters (15.08.2012)
Published in Bioorganic & medicinal chemistry letters (15.08.2012)
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Journal Article
Inhibitors of Ketohexokinase: Discovery of Pyrimidinopyrimidines with Specific Substitution that Complements the ATP-Binding Site
Maryanoff, Bruce E, O'Neill, John C, McComsey, David F, Yabut, Stephen C, Luci, Diane K, Jordan, Alfonzo D, Masucci, John A, Jones, William J, Abad, Marta C, Gibbs, Alan C, Petrounia, Ioanna
Published in ACS medicinal chemistry letters (14.07.2011)
Published in ACS medicinal chemistry letters (14.07.2011)
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Journal Article
Cycloaddition Reactions of Thiazolium Azomethine Ylides: Application to Pyrrolo[2,1-b]thiazoles
Berry, Craig R, Zificsak, Craig A, Gibbs, Alan C, Hlasta, Dennis J
Published in Organic letters (11.10.2007)
Published in Organic letters (11.10.2007)
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Journal Article
Synthesis and Identification of [1,2,4]Thiadiazole Derivatives as a New Series of Potent and Orally Active Dual Agonists of Peroxisome Proliferator-Activated Receptors α and δ
Shen, Lan, Zhang, Yan, Wang, Aihua, Sieber-McMaster, Ellen, Chen, Xiaoli, Pelton, Patricia, Xu, Jun Z, Yang, Maria, Zhu, Peifang, Zhou, Lubing, Reuman, Michael, Hu, Zhiyong, Russell, Ronald, Gibbs, Alan C, Ross, Hamish, Demarest, Keith, Murray, William V, Kuo, Gee-Hong
Published in Journal of medicinal chemistry (09.08.2007)
Published in Journal of medicinal chemistry (09.08.2007)
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Journal Article
Synthesis and structure–activity relationships of thiadiazole-derivatives as potent and orally active peroxisome proliferator-activated receptors α/δ dual agonists
Shen, Lan, Zhang, Yan, Wang, Aihua, Sieber-McMaster, Ellen, Chen, Xiaoli, Pelton, Patricia, Xu, June Z., Yang, Maria, Zhu, Peifang, Zhou, Lubing, Reuman, Michael, Hu, Zhiyong, Russell, Ronald, Gibbs, Alan C., Ross, Hamish, Demarest, Keith, Murray, William V., Kuo, Gee-Hong
Published in Bioorganic & medicinal chemistry (15.03.2008)
Published in Bioorganic & medicinal chemistry (15.03.2008)
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Journal Article
A Cluster-Based Strategy for Assessing the Overlap between Large Chemical Libraries and Its Application to a Recent Acquisition
Engels, Michael F. M, Gibbs, Alan C, Jaeger, Edward P, Verbinnen, Danny, Lobanov, Victor S, Agrafiotis, Dimitris K
Published in Journal of chemical information and modeling (01.11.2006)
Published in Journal of chemical information and modeling (01.11.2006)
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Journal Article
Nanosecond Temperature Jump Relaxation Dynamics of Cyclic β-Hairpin Peptides
Maness, Shelia J., Franzen, Stefan, Gibbs, Alan C., Causgrove, Timothy P., Dyer, R. Brian
Published in Biophysical journal (01.06.2003)
Published in Biophysical journal (01.06.2003)
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Journal Article