Login / Signup

Effect of methylation on relative energies of tautomers and on the intramolecular proton transfer barriers of protonated nitrosamine: A MR-CISD study.

Railton Barbosa de AndradeEzequiel Fragoso Vieira LeitãoMiguel Angelo Fonseca de SouzaElizete VenturaSilmar Andrade do Monte
Published in: J. Comput. Chem. (2015)
Keyphrases
  • database
  • case study
  • higher order
  • medical images
  • empirical studies
  • machine learning
  • information systems
  • website
  • image data
  • simulation study
  • energy minimization
  • knowledge transfer