Package schrodinger :: Package application :: Package glide :: Package packages :: Module driver :: Class SplitDockingSubjob
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Class SplitDockingSubjob

             object --+        
                      |        
DockingJobFilenameMixin --+    
                          |    
              DockingSubjob --+
                              |
                             SplitDockingSubjob

Objects of this class represent docking subjobs using a split ligand input file. The ligand file is constructed from the jobname, and adding ligands to the job causes them to be appended to the ligand file.

Instance Methods [hide private]
 
__init__(self, jobname, index, lignum, job, maxligs, **d)
x.__init__(...) initializes x; see help(type(x)) for signature
 
addLigand(self, st)
 
close(self)
 
filesToDelete(self)

Inherited from DockingSubjob: __getattr__, __str__, checkMolID, filesToArchive, getLignum, getScore, isDone, isFull, poseReader, setLigfile, setupKeywords, writeInputFile

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

Class Variables [hide private]

Inherited from DockingSubjob: excluded_keywords

Properties [hide private]

Inherited from DockingSubjob: compress_poses, cpu_time, input_filename, pose_format, pose_outtype

Inherited from DockingJobFilenameMixin: gz_ext, log_filename, out_ext, out_suffix, output_filename, outputdir, raw_filename, raw_suffix, skippedligs_filename, vcsm_filename

Inherited from object: __class__

Method Details [hide private]

__init__(self, jobname, index, lignum, job, maxligs, **d)
(Constructor)

 

x.__init__(...) initializes x; see help(type(x)) for signature

Overrides: object.__init__
(inherited documentation)

addLigand(self, st)

 
Overrides: DockingSubjob.addLigand

close(self)

 
Overrides: DockingSubjob.close

filesToDelete(self)

 
Overrides: DockingSubjob.filesToDelete