Canonical, Deprotonated or Zwitterionic? A Computational Study on Amino Acid Interaction with the TiO2 (101) Anatase Surface
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DOI: 10.1021/acs.jpcc.7b03305
Abstract: The interaction of 11 amino acids with the TiO2 (101) anatase surface was investigated by means of PBE-D2* periodic simulations, both from a static and dynamic points of view. Several adsorption states, with the amino… read more here.
Keywords: amino acids; amino acid; surface; tio2 101 ... See more keywords