Glide

A complete solution for ligand-receptor docking

Below are selected publications from 2008; please check here to cite the use of Glide

  •   ö  Rao, S.; Sanschagrin, P. C.; Greenwood, J. R.; Repasky, M. P.; Sherman, W.; Farid, R., "Improving database enrichment through ensemble docking," J. Comput. Aided. Mol. Des., 2008, 22, 621-627
  •   Pierce, A.C.; Jacobs, M.; and Stuver-Moody, C., "Docking Study Yields Four Novel Inhibitors of the Protooncogene Pim-1 Kinase," J. Med. Chem., 2008, 51, 1972–1975
  •   Pauly, G.T.; Loktionova, N.A.; Fang, Q.; Vankayala, S.L.; Guida, W.C.; Pegg, A.E., "Substitution of Aminomethyl at the Meta-Position Enhances the Inactivation of O(6)-Alkylguanine-DNA Alkyltransferase by O(6)-Benzylguanine," J. Med. Chem., 2008, 51, 7144–7153
  •   Bembenek, S.D.; Keith, J.M.; Letavic, M.A.; Apodaca, R.; Barbier, A.J.; Dvorak, L.; Aluisio, L.; Miller, K.L.; Lovenberg, T.W.; Carruthers, N.I., "Lead identification of acetylcholinesterase inhibitors–histamine H3 receptor antagonists from molecular modeling," Bioorg. & Med. Chem., 2008, 16, 2968-2973
  •   Lawrence, S.H.; Ramirez, U.D.; Tang, L.; Fazliyez, F.; Kundrat, L.; Markham, G.D.; Jaffe, E.K., "Shape shifting leads to small-molecule allosteric drug discovery," Chem Biol., 2008, 15, 586-96
  •   Cheng, J.-F.; Zapf, J.; Takedomi, K.; Fukushima, C.; Ogiku, T. Zhang S.-H.; Yang, G.; Sakurai, N.; Barbosa, M.; Jack, R.; Xu, K., "Combination of Virtual Screening and High Throughput Gene Profiling for Identification of Novel Liver X Receptor Modulators," J. Med. Chem., 2008, 51, 2057-2061
  •   Degel, B.; Staib, P.; Rohrer, S.; Scheiber, J.; Martina, E.; Büchold, C.; Baumann, K.; Morschhäuser, J.; Schirmeister, T., "Cis-Configured Aziridines Are New Pseudo-Irreversible Dual-Mode Inhibitors of Candida albicans Secreted Aspartic Protease 2," Chem. Med. Chem., 2008, 3, 302-315
  • ö indicates papers (co)authored by Schrödinger scientist(s).
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