Package schrodinger :: Package application :: Package moldescriptors :: Module startup

Module startup

A simple Python script that acts as startup script of molecular descriptor backend.

Functions

parse_args(argsList)

start_job(structfile, args, configfile='', omae='', ocsv='', list=False, nojobid=False, wait=False, replacecomma=None, skipfailed=None)
Starts the job to calculate the descriptors

Variables

[hide private]

__doc__ = ...

_version = '$Revision: 0.0 $'

debug = False
hash(x)

local_backend_script = '/nfs/builds/objects/OB/2014-2/Linux-x8...

usage = '\nUsage1: Start GUI version of molecular descriptors....

__package__ = 'schrodinger.application.moldescriptors'

Variables Details

[hide private]

doc

Value:

"""

A simple Python script that acts as startup script of molecular descri
ptor
backend.

Copyright Schrodinger, LLC. All rights reserved.

...

local_backend_script

Value:

'/nfs/builds/objects/OB/2014-2/Linux-x86_64/build16/mmshare-v2.6/lib/L
inux-x86_64/lib/python2.7/site-packages/schrodinger/application/moldes
criptors/backend.py'

usage

Value:

'''
Usage1: Start GUI version of molecular descriptors.

  startup.py -gui


Usage2: Start command line version of molecular descriptors.

...