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Rosetta
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Files | |
| file | RDKit.fwd.hh |
| Forward declarations which make working with RDKit nicer. | |
| file | RDMolToRestype.cc |
| A class for creating a residuetype based on a RDKit fragment. | |
| file | RDMolToRestype.hh |
| A class for creating a residuetype based on a RDKit molecule. | |
| file | RestypeToRDMol.cc |
| This class takes a residuetype from Rosetta and converts it into a RDKit RWMol object. | |
| file | RestypeToRDMol.hh |
| file | util.cc |
| Utilities for interacting with the RDKit library. | |
| file | util.hh |
| Utilities for interacting with the RDKit library. | |