schrodinger.application.jaguar.keywordDB module¶
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class
schrodinger.application.jaguar.keywordDB.
Keyword
(name, type, default, description=None, comment=None, index=0, boolean=None, qsite_allowed=None)¶ Bases:
object
A class to hold keyword info.
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__init__
(name, type, default, description=None, comment=None, index=0, boolean=None, qsite_allowed=None)¶ Initialize self. See help(type(self)) for accurate signature.
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get_macro
()¶ Return C-style macro string from Keyword attributes
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-
class
schrodinger.application.jaguar.keywordDB.
Setting
(name, code, value, description=None, comment=None)¶ Bases:
object
A class to hold keyword setting info.
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__init__
(name, code, value, description=None, comment=None)¶ Initialize self. See help(type(self)) for accurate signature.
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get_macro
()¶ Return C-style macro string from Setting attributes
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class
schrodinger.application.jaguar.keywordDB.
DTDTreeBuilder
¶ Bases:
xml.etree.ElementTree.TreeBuilder
- We create this subclass and redefine doctype() to avoid:
- “DeprecationWarning: This method of XMLParser is deprecated.
- Define doctype() method on the TreeBuilder target”
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doctype
(name, pubid, system)¶
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__init__
¶ Initialize self. See help(type(self)) for accurate signature.
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close
()¶
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data
()¶
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end
()¶
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start
()¶
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schrodinger.application.jaguar.keywordDB.
load_keywords
(filename)¶ Load keywords from an XML file in jaguar_keywords.dtd format. Return a list and dictionary of Keyword objects. Keyword names and values are stored in lowercase.