private void updatePkaType(ModelCompound compound, PkaType pkaType, int index)
{
var(compoundTypeParameter, pKaParameter) = pkaParametersFor(compound, index);
compoundTypeParameter.Value = (int)pkaType.Type;
pKaParameter.Value = pkaType.Pka;
}
private void setPka(ModelCompound compound, PkaType pkaType, int i)
{
var type = EnumHelper.ParseValue <CompoundType>(pkaType.Type);
setValue(compound, CoreConstants.Parameter.ParameterCompoundType(i), (int)type);
setValue(compound, CoreConstants.Parameter.ParameterPKa(i), pkaType.Value);
}
private void synchronizePkaValueOrigins(PkaType pkaType, ModelCompound compound)
{
var valueOrign = pkaType?.ValueOrigin;
if (valueOrign == null)
{
return;
}
//Making sure that all pKa parameters have the same value origin, even neutral ones
Enumerable.Range(0, CoreConstants.NUMBER_OF_PKA_PARAMETERS).Each(index =>
{
var(compoundTypeParameter, pKaParameter) = pkaParametersFor(compound, index);
_valueOriginMapper.UpdateValueOrigin(compoundTypeParameter.ValueOrigin, valueOrign);
_valueOriginMapper.UpdateValueOrigin(pKaParameter.ValueOrigin, valueOrign);
});
}