Genetic algorithms artificial neural networks, machine

Selection of the supervised classification technique or the combination of techniques suitable for accomplishing the classification task. Popular supervised classifiers are Multi-Layer Perceptron Artificial Neural Networks (MLP-ANN), Support Vector Machines (SVM), k-Nearest Neighbours (k-NN), combinations of genetic algorithms (GA) for feature selection with Linear Discriminant Analysis (LDA), Decision Trees and Radial Basis Function (RBF) classifiers. 

Artificial Intelligence in Chemistry Chemometrics Multivariate View on Chemical Problems Combinatorial Chemistry Design of Compounds for Physical Methods Genetic and Evolutionary Algorithms Machine Learning Techniques in Chemistry Neural Networks in Chemistry Partial Least Squares Projections to Latent Structures (PLS) in Chemistry Protein Folding and Optimisation... 

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