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Exploring Chloride Selectivity and Halogenase Regioselectivity of the SalL Enzyme through Quantum Mechanical/Molecular Mechanical Modeling.

Paulo R. M. PereiraJéssica de O. AraújoJosé Rogério A. SilvaCláudio Nahum AlvesJerônimo LameiraAnderson Henrique Lima e Lima
Published in: J. Chem. Inf. Model. (2020)
Keyphrases
  • quantum mechanics
  • mechanical design
  • database
  • databases
  • artificial intelligence
  • three dimensional
  • bayesian networks