Did I find the right examples for you? yes no      Crawl my project      Python Jobs

All Samples(7)  |  Call(3)  |  Derive(0)  |  Import(4)

src/p/y/Pymol-script-repo-HEAD/modules/ADT/AutoDockTools/Utilities24/process_VSResults.py   Pymol-script-repo(Download)
from AutoDockTools.Docking import Docking, DockingResultProcessor
from mglutil.math.rmsd import RMSDCalculator
from AutoDockTools.InteractionDetector import InteractionDetector
from MolKit.hydrogenBondBuilder import HydrogenBondBuilder
 
            if verbose: print param, '=', value
        hbB = apply(HydrogenBondBuilder, (), kw)
        intF = InteractionDetector(receptor_filename, detect_pi=detect_pi, hydrogen_bond_builder=hbB)
 
    drp = DockingResultProcessor(rms_tolerance=rms_tolerance,

src/p/y/Pymol-script-repo-HEAD/modules/ADT/AutoDockTools/Docking.py   Pymol-script-repo(Download)
from AutoDockTools.interactiveHistogramGraph import InteractiveHistogramGraph
from mglutil.math.rmsd import RMSDCalculator
from AutoDockTools.InteractionDetector import InteractionDetector
 
 
        self.docking = docking
        if self.intF==None:
            self.intF = InteractionDetector(self.receptor_filename, detect_pi=self.detect_pi) #someday, detect_pi=True
        self.rmsTool = None
        if rms_reference is not None:
        self.intD = intD
        if self.intD==None:
            self.intD = InteractionDetector(self.receptor_filename, detect_pi=self.detect_pi) 
 
 

src/p/y/Pymol-script-repo-HEAD/modules/ADT/AutoDockTools/Utilities24/process_VinaResult.py   Pymol-script-repo(Download)
from AutoDockTools.Docking import Docking, VinaResultProcessor
from mglutil.math.rmsd import RMSDCalculator
from AutoDockTools.InteractionDetector import InteractionDetector
 
 

src/p/y/Pymol-script-repo-HEAD/modules/ADT/AutoDockTools/autoanalyzeCommands.py   Pymol-script-repo(Download)
from AutoDockTools.cluster import Clusterer
from AutoDockTools import interactiveHistogramGraph
from AutoDockTools.InteractionDetector import InteractionDetector
 
from MolKit.torTree import TorTree