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D120_Ligand_interface.py File Reference

Namespaces

 demo.D120_Ligand_interface
 

Functions

def demo.D120_Ligand_interface.sample_ligand_interface
 Methods. More...
 

Variables

int demo.D120_Ligand_interface.counter = 0
 AddPyMOLObserver(test_pose, True) More...
 
tuple demo.D120_Ligand_interface.parser = optparse.OptionParser()
 INTERPRETING RESULTS. More...
 
string demo.D120_Ligand_interface.default = '../demos/data/test_lig.pdb'
 
string demo.D120_Ligand_interface.help = 'the PDB file containing the ligand and protein to dock'
 
 demo.D120_Ligand_interface.pdb_filename = options.pdb_filename
 
 demo.D120_Ligand_interface.partners = options.partners
 
tuple demo.D120_Ligand_interface.ligand_params = options.ligand_params.split(',')
 
tuple demo.D120_Ligand_interface.jobs = int(options.jobs)
 
 demo.D120_Ligand_interface.job_output = options.job_output