dimer_builder_step

• dimer_builder_step package
  • Submodules
  • dimer_builder_step.dimer_analysis module
    • Design notes
    • Dimer
      • Dimer.energy
      • Dimer.is_tail
      • Dimer.label
      • Dimer.orientation
      • Dimer.separation
      • Dimer.symbols_A
      • Dimer.symbols_B
      • Dimer.xyz_A
      • Dimer.xyz_B
    • DimerMetrics
      • DimerMetrics.R
      • DimerMetrics.approach_lonlat
      • DimerMetrics.approach_vec
      • DimerMetrics.contact_pairs
      • DimerMetrics.core_energy()
      • DimerMetrics.energy
      • DimerMetrics.has_energy
      • DimerMetrics.is_tail
      • DimerMetrics.min_contact
      • DimerMetrics.n
      • DimerMetrics.orient_angle
    • approach_concentration()
    • compute_metrics()
    • energy_histogram()
    • make_dashboard()
    • make_panels()
    • panel_approach()
    • panel_contact()
    • panel_energy()
    • panel_energy_vs_R()
    • panel_orientation()
    • panel_separation()
    • summarize()
  • dimer_builder_step.dimer_builder module
    • DimerBuilder
      • DimerBuilder.parser
      • DimerBuilder.options
      • DimerBuilder.subflowchart
      • DimerBuilder.parameters
      • DimerBuilder.analyze()
      • DimerBuilder.create_parser()
      • DimerBuilder.description_text()
      • DimerBuilder.git_revision
      • DimerBuilder.run()
      • DimerBuilder.set_id()
      • DimerBuilder.set_subids()
      • DimerBuilder.version
    • vdw_radii()
  • dimer_builder_step.dimer_builder_parameters module
    • DimerBuilderParameters
      • DimerBuilderParameters.parameters
      • DimerBuilderParameters.update()
    • monomer_selection_keys()
  • dimer_builder_step.dimer_builder_step module
    • DimerBuilderStep
      • DimerBuilderStep.create_node()
      • DimerBuilderStep.create_tk_node()
      • DimerBuilderStep.description()
      • DimerBuilderStep.my_description
  • dimer_builder_step.metadata module
  • dimer_builder_step.tk_dimer_builder module
    • TkDimerBuilder
      • TkDimerBuilder.create_dialog()
      • TkDimerBuilder.reset_dialog()
      • TkDimerBuilder.reset_parameters_frame()
      • TkDimerBuilder.right_click()
  • Module contents