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Classes
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| class |
BALL::AddHydrogenProcessor |
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Saturate atoms with hydrogen atoms.
More...
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| class |
BALL::AssignBondOrderProcessor |
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Bond Order
assignment processor. More...
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| class |
BALL::AtomTyper |
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Base class for a programable
Atom typer. More...
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| class |
BALL::BindingPocketProcessor |
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This processor searches for binding
pockets in a given atom container. More...
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| class |
BALL::BuildBondsProcessor |
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Bond
creation processor. More...
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| class |
BALL::ClearChargeProcessor |
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Clears the charge on all atoms.
More...
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| class |
BALL::ClearRadiusProcessor |
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Clears the radius of all atoms.
More...
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| class |
BALL::AssignRadiusProcessor |
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Assigns the radius to each atom.
More...
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| class |
BALL::AssignChargeProcessor |
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Assigns a charge to each atom.
More...
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| class |
BALL::FragmentDB |
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FragmentDB -
fragment database class. More...
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| class |
BALL::TransformationProcessor |
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Transformation applicator. More...
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| class |
BALL::HBondProcessor |
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This processor computes all hydrogen
bonds occuring between amino acids in the composite it is
applied to. More...
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| class |
BALL::HybridisationProcessor |
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Hybridisation processor. More...
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| class |
BALL::Kekuliser |
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Class to transform bonds with type
"aromatic" to conjugated single and double bonds. More...
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| class |
BALL::NodeItem< Node,
Edge > |
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The node type in a molecular graph.
More...
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| class |
BALL::ReconstructFragmentProcessor |
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ReconstructFragmentProcessor.
More...
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| class |
BALL::ResidueChecker |
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Residue Consistency Checker. More...
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| class |
BALL::SecondaryStructureProcessor |
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Secondary structure extraction from
3D structure. More...
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| class |
BALL::UCK |
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Unique Chemical Key. More...
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