Three-Dimensional Quantitative Structure-Property Relationship (3D-QSPR) Models for Prediction of Thermodynamic Properties of Polychlorinated Biphenyls (PCBs): Enthalpies of Fusion and Their Application to Estimates of Enthalpies of Sublimation and Aqueous Solubilities.
Swati PuriJames S. ChickosWilliam J. WelshPublished in: J. Chem. Inf. Comput. Sci. (2003)
Keyphrases
- three dimensional
- experimental data
- topological properties
- probabilistic model
- prediction accuracy
- desirable properties
- predictive model
- structural properties
- pattern recognition
- qualitative and quantitative
- prediction model
- image sequences
- expert systems
- artificial neural networks
- neural network
- dynamical systems
- printed circuit boards