Three-Dimensional Quantitative Structure-Property Relationship (3D-QSPR) Models for Prediction of Thermodynamic Properties of Polychlorinated Biphenyls (PCBs): Enthalpy of Vaporization.
Swati PuriJames S. ChickosWilliam J. WelshPublished in: J. Chem. Inf. Comput. Sci. (2002)
Keyphrases
- three dimensional
- prediction model
- topological properties
- probabilistic model
- experimental data
- structural properties
- desirable properties
- predictive model
- prediction accuracy
- case study
- models built
- algebraic properties
- knowledge management
- x ray
- complex systems
- independent variables
- pattern recognition
- surface model