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Performance of SuSi: A method for generating atomistic models of amorphous polymers based on a random search of energy minima.
David Curcó
Carlos Alemán
Published in:
J. Comput. Chem. (2004)
Keyphrases
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random search
probabilistic model
decision trees
support vector machine
prior knowledge
optimization algorithm
neural network
genetic algorithm
feature selection
similarity measure
training set
model selection
prior information
prediction model