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RDKit
Open-source cheminformatics and machine learning.
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#include <Target.h>
Public Attributes | |
| const ROMol * | Molecule |
| Graph | Topology |
| MatchTable | AtomMatchTable |
| MatchTable | BondMatchTable |
| MatchTable RDKit::FMCS::Target::AtomMatchTable |
| MatchTable RDKit::FMCS::Target::BondMatchTable |