Glide

A complete solution for ligand-receptor docking

Below are selected publications from 2004; please check here to cite the use of Glide

  •   Kirkpatrick, P., "Virtual screening: Gliding to success," Nature Reviews Drug Discovery, 2004, 3, 299
  •   ö  Halgren, T. A.; Murphy, R. B.; Friesner, R. A.; Beard, H. S.; Frye, L. L.; Pollard, W. T.; Banks, J. L., "Glide: A New Approach for Rapid, Accurate Docking and Scoring. 2. Enrichment Factors in Database Screening," J. Med. Chem., 2004, 47, 1750–1759
  •   ö  Friesner, R. A.; Banks, J. L.; Murphy, R. B.; Halgren, T. A.; Klicic, J. J.; Mainz, D. T.; Repasky, M. P.; Knoll, E. H.; Shaw, D. E.; Shelley, M.; Perry, J. K.; Francis, P.; Shenkin, P. S., "Glide: A New Approach for Rapid, Accurate Docking and Scoring. 1. Method and Assessment of Docking Accuracy," J. Med. Chem., 2004, 47, 1739–1749
  •   Klon, A. E.; Glick, M.; Davies, J. W., "Application of Machine Learning To Improve the Results of High-Throughput Docking Against the HIV-1 Protease," J. Chem. Inf. Comput. Sci., 2004, 44, 2216–2224
  •   Ruddat, V. C.; Mogul, R.; Chorny, I.; Chen, C.; Perrin, N.; Whitman, S.; Kenyon, V.; Jacobson, M. P.; Bernasconi, C. F.; Holman, T. R., "Tryptophan 500 and Arginine 707 Define Product and Substrate Active Site Binding in Soybean Lipoxygenase-1," Biochemistry, 2004, 43, 13063–13071
  •   Kellenberger, E.; Rodrigo, J.; Muller, P.; Rognan, D., "Comparative evaluation of eight docking tools for docking and virtual screening accuracy," Proteins, 2004, 57, 225–242
  •   Perola, E.; Walters, W.P.; Charifson, P.S., "A Detailed Comparison of Current Docking and Scoring Methods on Systems of Pharmaceutical Relevance," Proteins, 2004, 56, 235–249
  •   Klon, A. E.; Glick, M.; Thoma, M.; Acklin, P.; Davies, J. W., "Finding More Needles in the Haystack: A Simple and Efficient Method for Improving High-Throughput Docking Results," J. Med. Chem., 2004, 47, 2743–2749
  •   Bytheway, I.; Cochran, S., "Validation of Molecular Docking Calculations Involving FGF-1 and FGF-2," J. Med. Chem., 2004, 47, 1683-1693
  •   Kontoyianni, M.; McClellan, L. M.; Sokol, G. S., "Evaluation of Docking Performance: Comparative Data on Docking Algorithms," J. Med. Chem., 2004, 47, 558–565
  • ö indicates papers (co)authored by Schrödinger scientist(s).
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