Class VABCVolume

java.lang.Object
org.openscience.cdk.geometry.volume.VABCVolume

public class VABCVolume extends Object
Calculates the Van der Waals volume using the method proposed in [Zhao, Yuan H. et. al.. The Journal of Organic Chemistry. 2003. 68]. The method is limited to molecules with the following elements: H, C, N, O, F, Cl, Br, I, P, S, As, B, Si, Se, and Te.
Source code:
main
Belongs to CDK module:
standard
Keywords:
volume, molecular
  • Constructor Details

    • VABCVolume

      public VABCVolume()
  • Method Details