recent publications

• academic article

  • Morris, G. M., Huey, R., Lindstrom, W., Sanner, M. F., Belew, R. K., Goodsell, D. S., Olson, A. J. AutoDock4 and AutoDockTools4: automated docking with selective receptor flexibility Journal of Computational Chemistry  2009 30:2785-2791  DOI:10.1002/jcc.21256  PMID:19399780  PMCID:PMC2760638
  • Barglow, K. T., Saikatendu, K. S., Bracey, M. H., Huey, R., Morris, G. M., Olson, A. J., Stevens, R. C., Cravatt, B. F. Functional proteomic and structural insights into molecular recognition in the nitrilase family enzymes Biochemistry  2008 47:13514-13523  DOI:10.1021/bi801786y  PMID:19053248  PMCID:PMC2665915
  • Morris, G. M., Huey, R., Olson, A. J. Using AutoDock for ligand-receptor docking Current Protocols in Bioinformatics  2008 Chapter 8:Unit 8.14  DOI:10.1002/0471250953.bi0814s24  PMID:19085980
  • Huey, R., Morris, G. M., Olson, A. J., Goodsell, D. S. A semiempirical free energy force field with charge-based desolvation Journal of Computational Chemistry  2007 28:1145-1152  DOI:10.1002/jcc.20634  PMID:17274016
  • Huey, R., Goodsell, D. S., Morris, G. M., Olson, A. J. Grid-based hydrogen bond potentials with improved directionality Letters in Drug Design & Discovery  2004 1:178-183  DOI:10.2174/1570180043485581
  • Morris, G. M., Goodsell, D. S., Halliday, R. S., Huey, R., Hart, W. E., Belew, R. K., Olson, A. J. Automated docking using a Lamarckian genetic algorithm and an empirical binding free energy function Journal of Computational Chemistry  1998 19:1639-1662  DOI:10.1002/(sici)1096-987x(19981115)19:14<1639::aid-jcc10>3.0.co;2-b
  • Morris, G. M., Goodsell, D. S., Huey, R., Olson, A. J. Distributed automated docking of flexible ligands to proteins: parallel applications of AutoDock 2.4 Journal of Computer-Aided Molecular Design  1996 10:293-304  DOI:10.1007/bf00124499  PMID:8877701