Molecular Determinants of Vanilloid Sensitivity in TRPV1 von Gavva, Narender R, Klionsky, Lana, Qu, Yusheng, Shi, Licheng, Tamir, Rami, Edenson, Steve, Zhang, T J, Viswanadhan, Vellarkad N, Toth, Attila, Pearce, Larry V, Vanderah, Todd W, Porreca, Frank, Blumberg, Peter M, Lile, Jack, Sun, Yax, Wild, Ken, Louis, Jean-Claude, Treanor, James J S

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Prediction of Hydrophobic (Lipophilic) Properties of Small Organic Molecules Using Fragmental Methods:  An Analysis of ALOGP and CLOGP Methods von Ghose, Arup K, Viswanadhan, Vellarkad N, Wendoloski, John J

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Could MM-GBSA be accurate enough for calculation of absolute protein/ligand binding free energies? von Mulakala, Chandrika, Viswanadhan, Vellarkad N.

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An Information-Intensive Approach to the Molecular Pharmacology of Cancer von Weinstein, John N., Myers, Timothy G., O'Connor, Patrick M., Friend, Stephen H., Fornace, Albert J., Kohn, Kurt W., Fojo, Tito, Bates, Susan E., Rubinstein, Lawrence V., Anderson, N. Leigh, Buolamwini, John K., van Osdol, William W., Monks, Anne P., Scudiero, Dominic A., Sausville, Edward A., Zaharevitz, Daniel W., Bunow, Barry, Viswanadhan, Vellarkad N., Johnson, George S., Wittes, Robert E., Paull, Kenneth D.

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2-Aminothiadiazole inhibitors of AKT1 as potential cancer therapeutics von Zeng, Qingping, Bourbeau, Matthew P., Wohlhieter, G. Erich, Yao, Guomin, Monenschein, Holger, Rider, James T., Lee, Matthew R., Zhang, Shiwen, Lofgren, Julie, Freeman, Daniel, Li, Chun, Tominey, Elizabeth, Huang, Xin, Hoffman, Douglas, Yamane, Harvey, Tasker, Andrew S., Dominguez, Celia, Viswanadhan, Vellarkad N., Hungate, Randall, Zhang, Xiaoling

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Applying conformational selection theory to improve crossdocking efficiency in 3-phosphoinositide dependent protein kinase-1 von Kotasthane, Anuja, Mulakala, Chandrika, Viswanadhan, Vellarkad N.

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3D-QSAR analysis of TRPV1 inhibitors reveals a pharmacophore applicable to diverse scaffolds and clinical candidates von Kristam, Rajendra, Parmar, Vinod, Viswanadhan, Vellarkad N.

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A New Series of Orally Bioavailable Chemokine Receptor 9 (CCR9) Antagonists; Possible Agents for the Treatment of Inflammatory Bowel Disease von Kalindjian, S. Barret, Kadnur, Sanjay V, Hewson, Christopher A, Venkateshappa, Chandregowda, Juluri, Suresh, Kristam, Rajendra, Kulkarni, Bheemashankar, Mohammed, Zainuddin, Saxena, Rohit, Viswanadhan, Vellarkad N, Aiyar, Jayashree, McVey, Donna

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Toward a general predictive QSAR model for gamma-secretase inhibitors von Ajmani, Subhash, Janardhan, Sridhara, Viswanadhan, Vellarkad N.

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TRPV1 antagonism by piperazinyl-aryl compounds: A Topomer-CoMFA study and its use in virtual screening for identification of novel antagonists von Kristam, Rajendra, Rao, Shashidhar N., D’Cruz, Anne Sudha, Mahadevan, Vijayalakshmi, Viswanadhan, Vellarkad N.

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Pyrid-2-yl and 2-CyanoPhenyl fused heterocyclic compounds as human P2X3 inhibitors: a combined approach based on homology modelling, docking and QSAR analysis von Janardhan, Sridhara, Seth, Subhendu, Viswanadhan, Vellarkad N.

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Potent hFPRL1 (ALXR) agonists as potential anti-inflammatory agents von Bürli, Roland W., Xu, Han, Zou, Xiaoming, Muller, Kristine, Golden, Jennifer, Frohn, Mike, Adlam, Matthew, Plant, Matthew H., Wong, Min, McElvain, Michele, Regal, Kelly, Viswanadhan, Vellarkad N., Tagari, Philip, Hungate, Randall

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Neural Computing in Cancer Drug Development: Predicting Mechanism of Action von Weinstein, John N., Kohn, Kurt W., Grever, Michael R., Viswanadhan, Vellarkad N., Rubinstein, Lawrence V., Monks, Anne P., Scudiero, Dominic A., Welch, Lester, Koutsoukos, Antonis D., Chiausa, August J., Paull, Kenneth D.

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Atom Type Preferences, Structural Diversity, and Property Profiles of Known Drugs, Leads, and Nondrugs: A Comparative Assessment von Viswanadhan, Vellarkad N, Rajesh, Hariharan, Balaji, Vitukudi N

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Three-Dimensional Quantitative Structure−Activity Relationships and Activity Predictions of Human TRPV1 Channel Antagonists:  Comparative Molecular Field Analysis and Comparative M... von Viswanadhan, Vellarkad N, Sun, Yaxiong, Norman, Mark H

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Discovery of dihydroquinoxalinone acetamides containing bicyclic amines as potent Bradykinin B1 receptor antagonists von Chen, Jian Jeffrey, Qian, Wenyuan, Biswas, Kaustav, Viswanadhan, Vellarkad N., Askew, Benny C., Hitchcock, Stephen, Hungate, Randall W., Arik, Leyla, Johnson, Eileen

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Discovery of novel hydroxy-thiazoles as HIF-α prolyl hydroxylase inhibitors: SAR, synthesis, and modeling evaluation von Tegley, Christopher M., Viswanadhan, Vellarkad N., Biswas, Kaustav, Frohn, Michael J., Peterkin, Tanya A.N., Chang, Catherine, Bürli, Roland W., Dao, Jennifer H., Veith, Henrike, Rogers, Norma, Yoder, Sean C., Biddlecome, Gloria, Tagari, Philip, Allen, Jennifer R., Hungate, Randall W.

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Structure-activity relationships of 3,4-dihydro-1H-quinazolin-2-one derivatives as potential CDK5 inhibitors von RZASA, Robert M, KALLER, Matthew R, XIAOLING XIONG, WENGE ZHONG, NORMAN, Mark H, GANG LIU, MAGAL, Ella, NGUYEN, Thomas T, OSSLUND, Timothy D, POWERS, David, SANTORA, Vincent J, VISWANADHAN, Vellarkad N, WANG, Hui-Ling

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Novel Vanilloid Receptor-1 Antagonists:  1. Conformationally Restricted Analogues of trans-Cinnamides von Norman, Mark H, Zhu, Jiawang, Fotsch, Christopher, Bo, Yunxin, Chen, Ning, Chakrabarti, Partha, Doherty, Elizabeth M, Gavva, Narender R, Nishimura, Nobuko, Nixey, Thomas, Ognyanov, Vassil I, Rzasa, Robert M, Stec, Markian, Surapaneni, Sekhar, Tamir, Rami, Viswanadhan, Vellarkad N, Treanor, James J. S

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Identification of a Nonpeptidic and Conformationally Restricted Bradykinin B1 Receptor Antagonist with Anti-Inflammatory Activity von D'Amico, Derin C, Aya, Toshi, Human, Jason, Fotsch, Christopher, Chen, Jian Jeffrey, Biswas, Kaustav, Riahi, Bobby, Norman, Mark H, Willoughby, Christopher A, Hungate, Randall, Reider, Paul J, Biddlecome, Gloria, Lester-Zeiner, Dianna, Van Staden, Carlo, Johnson, Eileen, Kamassah, Augustus, Arik, Leyla, Wang, Judy, Viswanadhan, Vellarkad N, Groneberg, Robert D, Zhan, James, Suzuki, Hideo, Toro, Andras, Mareska, David A, Clarke, David E, Harvey, Darren M, Burgess, Laurence E, Laird, Ellen R, Askew, Benny, Ng, Gordon

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