schrodinger.application.desmond.envir module

Commonly used Desmond environment variables.

Copyright Schrodinger, LLC. All rights reserved.

class schrodinger.application.desmond.envir.CONST

Bases: object

HOME = '/home/buildbot'

SCHRODINGER = '/scr/buildbot/savedbuilds/2018-4/NB/build-145'

SCHRODINGER_UTILITIES = '/scr/buildbot/savedbuilds/2018-4/NB/build-145/utilities'

MULTISIM_EXEC = '/scr/buildbot/savedbuilds/2018-4/NB/build-145/utilities/multisim'

WATERMAP_VERSION = '3.7'

WATERMAP_EXEC_DIR = '/scr/buildbot/savedbuilds/2018-4/NB/build-145/watermap-v3.7/bin/Linux-x86_64'

DESMOND_VERSION = '5.6'

DESMOND_EXEC_DIR = '/scr/buildbot/savedbuilds/2018-4/NB/build-145/desmond-v5.6/bin/Linux-x86_64'

DESMOND_LIB_DIR = '/scr/buildbot/savedbuilds/2018-4/NB/build-145/desmond-v5.6/lib/Linux-x86_64'

MMSHARE_VERSION = '4.4'

MMSHARE_EXEC_DIR = '/scr/buildbot/savedbuilds/2018-4/NB/build-145/mmshare-v4.4/bin/Linux-x86_64'

DESMOND_DATA_DIR = '/scr/buildbot/savedbuilds/2018-4/NB/build-145/desmond-v5.6/data'

MMSHARE_DATA_DESMOND_DIR = '/scr/buildbot/savedbuilds/2018-4/NB/build-145/mmshare-v4.4/data/desmond'

__class__

alias of builtins.type

__delattr__

Implement delattr(self, name).

__dict__ = mappingproxy({'__module__': 'schrodinger.application.desmond.envir', 'HOME': '/home/buildbot', 'SCHRODINGER': '/scr/buildbot/savedbuilds/2018-4/NB/build-145', 'SCHRODINGER_UTILITIES': '/scr/buildbot/savedbuilds/2018-4/NB/build-145/utilities', 'MULTISIM_EXEC': '/scr/buildbot/savedbuilds/2018-4/NB/build-145/utilities/multisim', 'WATERMAP_VERSION': '3.7', 'WATERMAP_EXEC_DIR': '/scr/buildbot/savedbuilds/2018-4/NB/build-145/watermap-v3.7/bin/Linux-x86_64', 'DESMOND_VERSION': '5.6', 'DESMOND_EXEC_DIR': '/scr/buildbot/savedbuilds/2018-4/NB/build-145/desmond-v5.6/bin/Linux-x86_64', 'DESMOND_LIB_DIR': '/scr/buildbot/savedbuilds/2018-4/NB/build-145/desmond-v5.6/lib/Linux-x86_64', 'MMSHARE_VERSION': '4.4', 'MMSHARE_EXEC_DIR': '/scr/buildbot/savedbuilds/2018-4/NB/build-145/mmshare-v4.4/bin/Linux-x86_64', 'DESMOND_DATA_DIR': '/scr/buildbot/savedbuilds/2018-4/NB/build-145/desmond-v5.6/data', 'MMSHARE_DATA_DESMOND_DIR': <schrodinger.application.desmond.envir._create_when_needed object>, 'MMSHARE_SYSTEM_BUILDER_DATA_DIR': <schrodinger.application.desmond.envir._create_when_needed object>, '__dict__': <attribute '__dict__' of 'CONST' objects>, '__weakref__': <attribute '__weakref__' of 'CONST' objects>, '__doc__': None, 'DESMOND_DATA_DESMOND_DIR': '/scr/buildbot/savedbuilds/2018-4/NB/build-145/mmshare-v4.4/data/desmond', 'MMSHARE_SYSTEM_BULDER_DATA_DIR': '/scr/buildbot/savedbuilds/2018-4/NB/build-145/mmshare-v4.4/data/system_builder'})

__dir__() → list

default dir() implementation

__eq__

Return self==value.

__format__()

default object formatter

__ge__

Return self>=value.

__getattribute__

Return getattr(self, name).

__gt__

Return self>value.

__hash__

Return hash(self).

__init__

Initialize self. See help(type(self)) for accurate signature.

__init_subclass__()

This method is called when a class is subclassed.

The default implementation does nothing. It may be overridden to extend subclasses.

__le__

Return self<=value.

__lt__

Return self<value.

__module__ = 'schrodinger.application.desmond.envir'

__ne__

Return self!=value.

__new__()

Create and return a new object. See help(type) for accurate signature.

__reduce__()

helper for pickle

__reduce_ex__()

helper for pickle

__repr__

Return repr(self).

__setattr__

Implement setattr(self, name, value).

__sizeof__() → int

size of object in memory, in bytes

__str__

Return str(self).

__subclasshook__()

Abstract classes can override this to customize issubclass().

This is invoked early on by abc.ABCMeta.__subclasscheck__(). It should return True, False or NotImplemented. If it returns NotImplemented, the normal algorithm is used. Otherwise, it overrides the normal algorithm (and the outcome is cached).

__weakref__

list of weak references to the object (if defined)

MMSHARE_SYSTEM_BUILDER_DATA_DIR = '/scr/buildbot/savedbuilds/2018-4/NB/build-145/mmshare-v4.4/data/system_builder'

schrodinger.application.desmond.envir.get(varname, default=None)