aiidalab_chemshell

• aiidalab_chemshell package
  • Subpackages
    • aiidalab_chemshell.common package
      • Submodules
      • aiidalab_chemshell.common.chemshell module
      • aiidalab_chemshell.common.navigation module
      • aiidalab_chemshell.common.node_viewers module
      • aiidalab_chemshell.common.structure_uploader module
      • aiidalab_chemshell.common.utils module
      • Module contents
    • aiidalab_chemshell.models package
      • Submodules
      • aiidalab_chemshell.models.process module
      • aiidalab_chemshell.models.resources module
      • aiidalab_chemshell.models.results module
      • aiidalab_chemshell.models.structure module
      • aiidalab_chemshell.models.workflow module
      • Module contents
    • aiidalab_chemshell.wizards package
      • Subpackages
      • Submodules
      • aiidalab_chemshell.wizards.main_app module
      • aiidalab_chemshell.wizards.resources module
      • aiidalab_chemshell.wizards.results module
      • aiidalab_chemshell.wizards.structure module
      • Module contents
  • Submodules
  • aiidalab_chemshell.containers module
    • build_image()
    • build_sif()
    • check_apptainer()
    • check_docker()
    • chemshell_code_exists()
    • create_chemshell_code()
    • detect_engine()
    • docker_image_exists()
    • ensure_use_double_quotes()
    • get_localhost_computer()
    • image_exists()
    • pull_docker_image()
    • sif_exists()
    • sif_path()
  • aiidalab_chemshell.history module
    • HistoryApp
    • HistoryAppView
    • HistoryModel
  • aiidalab_chemshell.main module
    • App
    • AppView
    • BatchApp
    • MainApp
  • aiidalab_chemshell.process module
    • BaseAppModel
      • BaseAppModel.block_results
      • BaseAppModel.reset()
    • BatchAppModel
    • ChemShellProcess
      • ChemShellProcess.submit_process()
      • ChemShellProcess.validate_model()
    • MainAppModel
  • aiidalab_chemshell.resources module
    • ChemShellContainerSetupWidget
    • CodeSetupWidget
  • aiidalab_chemshell.utils module
    • get_app_dir()
    • get_chem_shell_params()
    • get_py_app_dir()
    • open_link_in_new_tab()
    • test_aiida_chemsh_import()
  • Module contents