Veerabahu Shanmugasundaram - Dissemin

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All papers authored by Veerabahu Shanmugasundaram

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2021 Steven A. Saenz

ORCID

, Andrea Local, Tiffany Carr, Arvind Shakya, Shivsmriti Koul, Haiqing Hu

ORCID

, Lisa Chourb, Justin Stedman, Jenna Malley

ORCID

, Laura Akullian D’Agostino

ORCID

, Veerabahu Shanmugasundaram

ORCID

, John Malona, C. Eric Schwartz, Lisa Beebe, Meghan Clements and 9 other authors

Small molecule allosteric inhibitors of RORγt block Th17-dependent inflammation and associated gene expression in vivo

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2019 Kathleen A. Farley

ORCID

, Ye Che, Armando Navarro-Vázquez

ORCID

, Chris Limberakis, Dennis Anderson, Jiangli Yan, Michael Shapiro, Veerabahu Shanmugasundaram

ORCID

, Roberto R. Gil

ORCID

Cyclic Peptide Design Guided by Residual Dipolar Couplings, J-Couplings, and Intramolecular Hydrogen Bond Analysis

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2018 Wei Chou Tseng, David C. Pryde, Katrina E. Yoger, Karen M. Padilla, Brett M. Antonio, Seungil Han, Veerabahu Shanmugasundaram

ORCID

, Aaron C. Gerlach

TRPA1 ankyrin repeat six interacts with a small molecule inhibitor chemotype

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Ye Che, Adam M. Gilbert, Veerabahu Shanmugasundaram

ORCID

, Mark C. Noe

Inducing protein-protein interactions with molecular glues

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Adelajda Zorba, Chuong Nguyen, Yingrong Xu, Jeremy Starr, Kris Borzilleri, James Smith, Hongyao Zhu, Kathleen A. Farley, WeiDong Ding, James Schiemer, Xidong Feng, Jeanne S. Chang, Daniel P. Uccello, Jennifer A. Young, Carmen N. Garcia-Irrizary and 18 other authors

Delineating the role of cooperativity in the design of potent PROTACs for BTK

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2017 Parag Sahasrabudhe, Veerabahu Shanmugasundaram

ORCID

, Mark Flanagan, Kris A. Borzilleri, Holly Heaslet, Anil Rane, Alex McColl, Tim Subashi, George Karam, Ron Sarver, Melissa Harris, Boris A. Chrunyk, Chakrapani Subramanyam, Thomas V. Magee, Kelly Fahnoe and 6 other authors

Driving Drug Discovery with Biophysical Information

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Matthew P. Harrigan

ORCID

, Keri A. McKiernan

ORCID

, Veerabahu Shanmugasundaram

ORCID

, Rajiah Aldrin Denny, Vijay S. Pande

Markov modeling reveals novel intracellular modulation of the human TREK-2 selectivity filter

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Shunzhou Wan, Agastya P. Bhati, Sarah Skerratt, Kiyoyuki Omoto, Veerabahu Shanmugasundaram

ORCID

, Sharan K. Bagal, Peter V. Coveney

ORCID

Evaluation and Characterization of Trk Kinase Inhibitors for the Treatment of Pain: Reliable Binding Affinity Predictions from Theory and Computation

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2016 Bradley Sherborne, Veerabahu Shanmugasundaram

ORCID

, Alan C. Cheng, Clara D. Christ, Renee L. DesJarlais, Jose S. Duca

ORCID

, Richard A. Lewis, Deborah A. Loughney, Eric S. Manas, Georgia B. McGaughey, Catherine E. Peishoff, Herman van Vlijmen

Collaborating to improve the use of free-energy and other quantitative methods in drug discovery

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Ana M. Pajor, Cesar A. de Oliveira, Kun Song, Kim Huard, Veerabahu Shanmugasundaram

ORCID

, Derek M. Erion

Molecular Basis for Inhibition of the Na+/Citrate Transporter NaCT (SLC13A5) by Dicarboxylate Inhibitors

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Kay Ahn, Markus Boehm, Matthew F. Brown, Jessica Calloway, Ye Che, Jinshan Chen, Kimberly F. Fennell, Kieran F. Geoghegan, Adam M. Gilbert, Jemy A. Gutierrez, Amit S. Kalgutkar, Adhiraj Lanba, Chris Limberakis, Thomas V. Magee, Inish O’Doherty and 14 other authors

Discovery of a Selective Covalent Inhibitor of Lysophospholipase-like 1 (LYPLAL1) as a Tool to Evaluate the Role of this Serine Hydrolase in Metabolism

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Veerabahu Shanmugasundaram

ORCID

, Liying Zhang, Christopher Poss, Jared Milbank, Jeremy Starr

Going Beyond R-Group Tables

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Rachelle J. Bienstock, Veerabahu Shanmugasundaram

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, Jürgen Bajorath

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2015 Veerabahu Shanmugasundaram

ORCID

, Liying Zhang, Shilva Kayastha, Antonio de la Vega de Leon, Dilyana Dimova, Jürgen Bajorath

Monitoring the Progression of Structure–Activity Relationship Information during Lead Optimization

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2014 Mark E. Flanagan, Joseph A. Abramite, Dennis P. Anderson, Ann Aulabaugh, Upendra P. Dahal, Adam M. Gilbert, Chao Li, Justin Montgomery, Stacey R. Oppenheimer, Tim Ryder, Brandon P. Schuff, Daniel P. Uccello, Gregory S. Walker, Yan Wu, Matthew F. Brown and 10 other authors

Chemical and Computational Methods for the Characterization of Covalent Reactive Groups for the Prospective Design of Irreversible Inhibitors

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R. Ian Storer, Paul E. Brennan, Alan D. Brown, Peter J. Bungay, Kelly M. Conlon, Matthew S. Corbett, Robert P. DePianta, Paul V. Fish, Alexander Heifetz, Danny K. H. Ho, Alan S. Jessiman, Gordon McMurray, Cesar Augusto F. de Oliveira, Lee R. Roberts, James A. Root and 7 other authors

Multiparameter Optimization in CNS Drug Discovery: Design of Pyrimido[4,5-d]azepines as Potent 5-Hydroxytryptamine 2C (5-HT2C) Receptor Agonists with Exquisite Functional Selectivity over 5-HT2A and 5-HT2B Receptors

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Jeremy Starr, Matthew F. Brown, Lisa Aschenbrenner, Nicole Caspers, Ye Che, Brian S. Gerstenberger, Michael Huband, John D. Knafels, M. Megan Lemmon, Chao Li, Sandra P. McCurdy, Eric McElroy, Mark R. Rauckhorst, Andrew P. Tomaras, Jennifer A. Young and 3 other authors

Siderophore Receptor-Mediated Uptake of Lactivicin Analogues in Gram-Negative Bacteria

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Disha Gupta-Ostermann, Veerabahu Shanmugasundaram

ORCID

, Jürgen Bajorath

Neighborhood-Based Prediction of Novel Active Compounds from SAR Matrices

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2013 Matthew F. Brown, Mark J. Mitton-Fry, Joel T. Arcari, Rose Barham, Jeffrey Casavant, Brian S. Gerstenberger, Seungil Han, Joel R. Hardink, Thomas M. Harris, Thuy Hoang, Michael D. Huband, Manjinder S. Lall, M. Megan Lemmon, Chao Li, Jian Lin and 17 other authors

Pyridone-Conjugated Monobactam Antibiotics with Gram-Negative Activity

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Thomas V. Magee, Seungil Han, Sandra P. McCurdy, Thuy-Trinh Nguyen, Karl Granskog, Eric S. Marr, Bruce A. Maguire, Michael D. Huband, Jinshan Michael Chen, Timothy A. Subashi, Veerabahu Shanmugasundaram

ORCID

Novel 3-O-carbamoyl erythromycin A derivatives (carbamolides) with activity against resistant staphylococcal and streptococcal isolates

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