OEZap7Version¶
See also
OEAssignZap7Radii
function
This namespace contains the following constants:
Undefined
CarbonylOxygen
Zap7 radii version in which carbonyl oxygens radii parameter is increased with respect to the Bondi radius, while all other oxygens have radii set at Bondi values.
DoublyBondedOxygen
Modified version of Zap7 radii in which in addition to carbonyl oxygens, all other doubly bonded oxygens have increased radii parameter with respect to the Bondi radii (see Table 2 in [Nicholls-2010]).
Default
Same as the OEZap7Version_CarbonylOxygen
constant.