Prediction of Chromatographic Retention Values (RM) and Partition Coefficients (log Poct) Using a Combination of Semiempirical Self-Consistent Reaction Field Calculations and Neural Networks.
Jörg GrunenbergRainer HergesPublished in: J. Chem. Inf. Comput. Sci. (1995)
Keyphrases
- neural network
- prediction accuracy
- pattern recognition
- linear prediction
- prediction model
- neural network ensemble
- artificial neural networks to predict
- back propagation
- linear combination
- genetic algorithm
- prediction error
- prediction algorithm
- fuzzy logic
- long term
- artificial neural networks
- predicted values
- neural network model
- recurrent neural networks
- associative memory
- pixel values
- expert systems
- image processing