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src/b/i/biskit-2.4/Biskit/Dock/delphiBindingEnergy.py   biskit(Download)
 
from Biskit import PDBModel
from Biskit import Delphi, DelphiError
from Biskit import StdLog
from Biskit import Reduce, AtomCharger
        params['addcharge'] = False   # run AtomCharger once for complex only
 
        d = Delphi( model, **params )
        d.setGrid( **grid )