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EON Publications

Featured Publications

M. Lopez-Ramos and F. Perruccio, "HPPD: Ligand- and Target-Based Virtual Screening on a Herbicide Target", J. Chem. Inf. Model., 2010, 50 (5), pp 801-814

E. Naylor, A. Arredouani, S.R. Vasudevan, A.M. Lewis, R. Parkesh, A. Mizote, D. Rosen, J.M. Thomas, M. Izumi, A. Ganesan, A. Galione and G.C. Churchill, "Identification of a chemical probe for NAADP by virtual screening", Nature Chemical Biology, 2009, 5, pp 220-226

M.I. Zavodsky, A. Rohatgim, J.R. Van Voorst, H. Yan and L.E. Kuhn, "Scoring ligand similarity in structure-based virtual screening", J. Mol. Recog., 2009, 22 (4), pp 280-292

G. Tresadern, D. Bemporad and T. Howe, "A Comparison of Ligand Based Virtual Screening Methods and Application to Corticotropin Releasing Factor 1 Receptor", J. Mol. Graph. and Model., 2009, 27 (8), pp 860-870

P. Markt, R.K. Petersen, E.N Flindt, K. Kristiansen, J. Kirchmair, G. Spitzer, S. Distinito, D. Schuster, G. Wolber, C. Laggner and T. Langer, "Discovery of Novel PPAR Ligands by a Virtual Screening Approach Based on Pharmacophore Modeling, 3D Shape, and Electrostatic Similarity Screening", J. Med. Chem., 2008, 51 (20), pp 6303-6317

S.W. Muchmore, A.J. Souers and I. Akritopoulou-Zanze, "The Use of Three-Dimensional Shape and Electrostatic Similarity Searching in the Identification of a Melanin-Concentrating Hormone Receptor 1 Antagonist", Chemical Biology & Drug Design, 2006, 67 (2), pp 174-176

Publications by Date

M. Lopez-Ramos and F. Perruccio, "HPPD: Ligand- and Target-Based Virtual Screening on a Herbicide Target", J. Chem. Inf. Model., 2010, 50 (5), pp 801-814

E. Naylor, A. Arredouani, S.R. Vasudevan, A.M. Lewis, R. Parkesh, A. Mizote, D. Rosen, J.M. Thomas, M. Izumi, A. Ganesan, A. Galione and G.C. Churchill, "Identification of a chemical probe for NAADP by virtual screening", Nature Chemical Biology, 2009, 5, pp 220-226

M.I. Zavodsky, A. Rohatgim, J.R. Van Voorst, H. Yan and L.E. Kuhn, "Scoring ligand similarity in structure-based virtual screening", J. Mol. Recog., 2009, 22 (4), pp 280-292

G. Tresadern, D. Bemporad and T. Howe, "A Comparison of Ligand Based Virtual Screening Methods and Application to Corticotropin Releasing Factor 1 Receptor", J. Mol. Graph. and Model., 2009, 27 (8), pp 860-870

P. Markt, R.K. Petersen, E.N Flindt, K. Kristiansen, J. Kirchmair, G. Spitzer, S. Distinito, D. Schuster, G. Wolber, C. Laggner and T. Langer, "Discovery of Novel PPAR Ligands by a Virtual Screening Approach Based on Pharmacophore Modeling, 3D Shape, and Electrostatic Similarity Screening", J. Med. Chem., 2008, 51 (20), pp 6303-6317

S.W. Muchmore, A.J. Souers and I. Akritopoulou-Zanze, "The Use of Three-Dimensional Shape and Electrostatic Similarity Searching in the Identification of a Melanin-Concentrating Hormone Receptor 1 Antagonist", Chemical Biology & Drug Design, 2006, 67 (2), pp 174-176

Bibliography & Related Publications

J.A. Grant, B.T. Pickup, M.J. Sykes, C.A. Kitchen and A. Nicholls, "A simple formula for dielectric polarisation energies: The Sheffield Solvation Model", Chemical Physics Letters, 2007, 441 (1-3), pp 163-166