Class ChargedGroupDetector


  • public class ChargedGroupDetector
    extends java.lang.Object
    derives charged groups
    Author:
    wahljo1
    • Constructor Detail

      • ChargedGroupDetector

        public ChargedGroupDetector​(StereoMolecule mol)
    • Method Detail

      • detect

        public java.util.ArrayList<ChargePoint> detect()
      • getChargedGroups

        public java.util.List<java.util.ArrayList<java.lang.Integer>> getChargedGroups()