Class ProbeScanning


  • public class ProbeScanning
    extends java.lang.Object
    scans a receptor binding site for interaction points using a probe atom
    Author:
    wahljo1
    • Constructor Detail

      • ProbeScanning

        public ProbeScanning​(StereoMolecule receptor,
                             java.util.Set<java.lang.Integer> bindingSiteAtoms,
                             MoleculeGrid grid)