OEMultistatepKaModelpH
Attention
This is a preliminary API and may be improved based on user feedback. It is currently available in C++ and Python.
This namespace contains constants used by the class OEMultistatepKaModel and OEMultistatepKaModelOptions to define the pH at which the multistate model assesses the pKa.
See also
OEMultistatepKaModel class
OEAdjTypeAtNeutralpHconstants namespaceOEMultistatepKaModelpHconstants namespaceOEGetMultistatepKaModelpHNamefunctionOEGetMultistatepKaModelpHTypefunction
Neutral
MultistatepKaModel assesses the pKa at Neutral pH (physiological pH i.e. 7.4).
Unknown
This constant represents an undefined or illegal context state.