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Predicting pKa Using a Combination of Semi-Empirical Quantum Mechanics and Radial Basis Function Methods.
Peter A. Hunt
Layla Hosseini-Gerami
Tomas Chrien
Jeffrey Plante
David J. Ponting
Matthew D. Segall
Published in:
J. Chem. Inf. Model. (2020)
Keyphrases
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radial basis function
rbf network
quantum mechanics
machine learning
support vector machine svm
rbf neural network
learning algorithm
artificial neural networks
genetic programming