Module purr::feature [−][src]
Common components used in graph
and tree
representations.
Structs
Number | An integer from zero to 1,000. |
Enums
Aliphatic | Atomic symbols that can be aliphatic. |
Aromatic | Atomic symbols that can be aromatic. |
AtomKind | Minimal context-sensitive representation of an atom kind. |
BondKind | A kind of bond. Elided bonds are not present in the corresponding string representation. |
BracketAromatic | Eligible symbols for aromatic bracket atoms. |
BracketSymbol | Represents those atomic symbols capable of appearing within a bracket atom in the string representation. |
Charge | An integer charge from -15 to +15. |
Configuration | Representation of a configurational template. Most applications
will use only |
Element | Complete and up-to-date set of atomic symbols. |
Rnum | |
VirtualHydrogen | Represents the virtual hydrogen count on a bracket atom. See: Hydrogen Suppression in SMILES. |