29 #ifndef CDPL_CHEM_REACTIONCENTERSTATUS_HPP
30 #define CDPL_CHEM_REACTIONCENTERSTATUS_HPP
46 namespace ReactionCenterStatus
52 constexpr
unsigned int NONE = 0;
constexpr unsigned int BOND_MADE
Specifies that the bond is made by the reaction.
Definition: ReactionCenterStatus.hpp:68
constexpr unsigned int STEREO_RETENTION
Specifies that the configuration of the atom is retained in the reaction.
Definition: ReactionCenterStatus.hpp:93
constexpr unsigned int EXACT_CHANGE
Specifies that the change of the atom is exactly as specified.
Definition: ReactionCenterStatus.hpp:98
constexpr unsigned int IS_CENTER
Specifies that the bond is part of the reaction center.
Definition: ReactionCenterStatus.hpp:63
constexpr unsigned int NO_CENTER
Specifies for bonds in a reaction substructure search query that matching target bonds must not be pa...
Definition: ReactionCenterStatus.hpp:58
constexpr unsigned int NONE
Specifies that the atom or bond is not part of the reaction center.
Definition: ReactionCenterStatus.hpp:52
constexpr unsigned int STEREO_INVERSION
Specifies that the configuration of the atom is inverted by the reaction.
Definition: ReactionCenterStatus.hpp:88
constexpr unsigned int NO_CHANGE
Specifies that the bond is left unaltered by the reaction.
Definition: ReactionCenterStatus.hpp:83
constexpr unsigned int BOND_BROKEN
Specifies that the bond is broken by the reaction.
Definition: ReactionCenterStatus.hpp:73
constexpr unsigned int BOND_ORDER_CHANGE
Specifies that the bond order is changed by the reaction.
Definition: ReactionCenterStatus.hpp:78
The namespace of the Chemical Data Processing Library.