schrodinger.ui.qt.appframework.StartDialogParams

Class StartDialogParams

object --+ | StartDialogParams

A collection of parameter values from the StartDialog class.

Instance Methods

__init__(self)
Initialize.

list

commandLineArgs(self, include_njobs=True, include_mpi=True, add_cpus=True, include_host=True)
Convert this set of start dialog parameters into the canonical jobcontrol command line argument list.

commandLineOptions(self)
Convert this set of start dialog parameters into the canonical jobcontrol command line options.

list

formJaguarCPUFlags(self)
Determine the command line flags as requested by the user if mpicpus=True or cpus=True was used in creating the dialog

update(self, params)
Update the param's attributes based on the given dictionary.

Inherited from object: __delattr__, __format__, __getattribute__, __hash__, __new__, __reduce__, __reduce_ex__, __repr__, __setattr__, __sizeof__, __str__, __subclasshook__

init(self)
(Constructor)

Initialize. The defaults are used for options that were not requested njobs is not currently used as there is no uniform way to set it

Overrides: object.__init__

commandLineArgs(self, include_njobs=True, include_mpi=True, add_cpus=True, include_host=True)

Convert this set of start dialog parameters into the canonical jobcontrol command line argument list.

Parameters:

include_mpi (bool) - If True and mpicpus=True was given as a dialog initialization parameter, include the command line arguments -PARALLEL or -OMPI & -TPP set to user requested values
include_host (bool) - If True, the host will be included in the output arguments. If False, host will be excluded.

Returns: list

list of job control command line flags

commandLineOptions(self)

Convert this set of start dialog parameters into the canonical jobcontrol command line options. NOTE: Does NOT export NJOBS for backward compatability.

formJaguarCPUFlags(self)

Determine the command line flags as requested by the user if mpicpus=True or cpus=True was used in creating the dialog

Returns: list: Empty if mpicpus or cpus was not True, contains -PARALLEL flag if mpicpus was not True or user did not specify threads, or -OMPI & -TPP flags if user specified theads.

Class StartDialogParams

__init__(self) (Constructor)

commandLineArgs(self, include_njobs=True, include_mpi=True, add_cpus=True, include_host=True)

commandLineOptions(self)

formJaguarCPUFlags(self)

init(self)
(Constructor)