MacroModel

Versatile, full-featured program for molecular modeling

Below are selected publications from 2003; please check here to cite the use of MacroModel

  •   Smith, L.; Zachariah, C.; Thirumoorthy, R.; Rocca, J.; Novak, J.; Hillman, J. D.; Edison, A. S., "Structure and Dynamics of the Lantibiotic Mutacin 1140," Biochemistry , 2003, 42, 10372-10384
  •   Simon, C.; Barathieu, K.; Laguerre, M.; Schmitter, J.-M.; Fouquet, E.; Pianet, I.; Dufourc, E. J., "Three-Dimensional Structure and Dynamics of Wine Tannin-Saliva Protein Complexes. A Multitechnique Approach," Biochemistry , 2003, 42, 10385-10395
  •   Greenidge, P. A.; Mérette, S. A. M.; Beck, R.; Dodson, G.; Goodwin, C. A.; Scully, M. F.; Spencer, J.; Weiser, J.; Deadman, J. J., "Generation of Ligand Conformations in Continuum Solvent Consistent with Protein Active Site Topology: Application to Thromb," J. Med. Chem., 2003, 46, 1293-1305
  •   Bergstrom, C. A. S.; Norinder, U.; Luthman, K.; Artursson, P., "Molecular Descriptors influencing melting point and their role in classification of solid drugs," J. Chem. Inf. Comput. Sci., 2003, 43, 1177-1185
  •   Price, M. L. P.; Guida, W. C.; Jackson, T. C.; Nydick, J. A.; Gladstone, P. L.; Juarez, J. C.; Doñate, F.; Ternansky, R. J., "Design of Novel N-(2,4-Dioxo-1,2,3,4-tetrahydro-thieno[3,2-d]pyrimidin-7-yl)-guanidines as Thymidine Phosphorylase Inhibitors, and Flexible Docking to a Homology Model ," Bioorganic & Medicinal Chem. Lett. , 2003, 13, 107-110
  • ö indicates papers (co)authored by Schrödinger scientist(s).
  • Download Software

    Download the Schrödinger Suite now to try out the software.

    GO
  • Explore the Knowledge Base

    Find more information by searching our Knowledge Base.

    GO
  • Get Support

    Contact our Scientific and Technical Support team.

    GO
  • Product List

    View a complete list of all products.

    GO