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See:
Description
| Interface Summary | |
|---|---|
| MoleculeIterators.AtomIteratorInterface | Classes that implement the AtomIteratorInterface interface
enumerate atoms of a molecule. |
| MoleculeIterators.AtomPropertyInterface | This class provides a uniform interface to access atom properties of various molecules. |
| MoleculeIterators.BondIteratorInterface | Classes that implement the BondIteratorInterface interface
enumerate bonds of a molecule. |
| MoleculeIterators.MoleculeInterface | Classes that have AtomIteratorInterface interface that enumerates atoms,
and BondIteratorInterface interface that enumerates bonds. |
| Class Summary | |
|---|---|
| AutoMapper | AutoMapper finds the best mapping from reactant side atoms
to product side atoms of a reaction. |
| MacroMolecule | The MacroMolecule class provides the internal representation
of biochemical data stored in PDB files. |
| MacroMolecule.BondMaker | |
| MoleculeIterators | The MoleculeIterators is a collection of iterators that
enumerate atoms and bonds of molecules. |
| PDBReader | Import module for PDB files, replaces old PDBImport. |
| Exception Summary |
|---|
Marvin modules.
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