|
Classes |
|
| class | BALL::AddHydrogenProcessor |
| Saturate atoms with hydrogen atoms.
More... |
|
| class | BALL::AssignBondOrderProcessor |
| Bond Order
assignment processor. More... |
|
| class | BALL::AtomTyper |
| Base class for a programable
Atom typer. More... |
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| class | BALL::BindingPocketProcessor |
| This processor searches for binding
pockets in a given atom container. More... |
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| class | BALL::BuildBondsProcessor |
| Bond
creation processor. More... |
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| class | BALL::ClearChargeProcessor |
| Clears the charge on all atoms.
More... |
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| class | BALL::ClearRadiusProcessor |
| Clears the radius of all atoms.
More... |
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| class | BALL::AssignRadiusProcessor |
| Assigns the radius to each atom.
More... |
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| class | BALL::AssignChargeProcessor |
| Assigns a charge to each atom.
More... |
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| class | BALL::FragmentDB |
| FragmentDB -
fragment database class. More... |
|
| class | BALL::TransformationProcessor |
| Transformation applicator. More... |
|
| class | BALL::HBondProcessor |
| This processor computes all hydrogen
bonds occuring between amino acids in the composite it is
applied to. More... |
|
| class | BALL::HybridisationProcessor |
| Hybridisation processor. More... |
|
| class | BALL::Kekuliser |
| Class to transform bonds with type
"aromatic" to conjugated single and double bonds. More... |
|
| class | BALL::NodeItem< Node, Edge > |
| The node type in a molecular graph.
More... |
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| class | BALL::ReconstructFragmentProcessor |
| ReconstructFragmentProcessor.
More... |
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| class | BALL::ResidueChecker |
| Residue Consistency Checker. More... |
|
| class | BALL::SecondaryStructureProcessor |
| Secondary structure extraction from
3D structure. More... |
|
| class | BALL::UCK |
| Unique Chemical Key. More... |
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1.5.8