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Mechanism of enhanced conversion of 1, 2, 3-trichloropropane by mutant haloalkane dehalogenase revealed by molecular modeling.
Pavel Banás
Michal Otyepka
Petr Jerábek
Martin Petrek
Jirí Damborský
Published in:
J. Comput. Aided Mol. Des. (2006)
Keyphrases
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three dimensional
differential evolution
neural network
expert systems
modeling method