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RxDock 0.1.0
A fast, versatile, and open-source program for docking ligands to proteins and nucleic acids
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Public Member Functions | |
| HeavyAtomFactory (ModelList modelList) | |
| virtual void | VisitReceptorFlexData (ReceptorFlexData *) |
| virtual void | VisitLigandFlexData (LigandFlexData *) |
| virtual void | VisitSolventFlexData (SolventFlexData *) |
| AtomRList | GetAtomList () const |
| virtual void | VisitReceptorFlexData (ReceptorFlexData *)=0 |
| virtual void | VisitLigandFlexData (LigandFlexData *)=0 |
| virtual void | VisitSolventFlexData (SolventFlexData *)=0 |
Friends | |
| void | to_json (json &j, const HeavyAtomFactory &heavyAtomFactory) |
| void | from_json (const json &j, HeavyAtomFactory &heavyAtomFactory) |
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virtual |
Implements rxdock::FlexDataVisitor.
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virtual |
Implements rxdock::FlexDataVisitor.
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virtual |
Implements rxdock::FlexDataVisitor.