Class DruglikenessPredictor

constructor

• new DruglikenessPredictor(): DruglikenessPredictor

• Returns DruglikenessPredictor

Static DRUGLIKENESS_UNKNOWN

assessDruglikeness

• assessDruglikeness(molecule): number

• Returns the calculated drug likeness as a double.

  Parameters

  • molecule: Molecule

  Returns number

getDetail

• getDetail(): IParameterizedString[]

• Returns detailed information about the previous drug likeness assessment.

  Returns IParameterizedString[]

getDruglikenessString

• getDruglikenessString(molecule): string

• Parameters

  • molecule: Molecule

  Returns string

getOCL

• getOCL(): any

• Returns the OCL object.

  Returns any