Quantum mechanical modeling of a tripodal [2]rotaxane and its binding to TiO2

Choongkeun Lee, Gloria Maeng, Hae Won Kim, Karl Sohlberg

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All Science Journal Classification (ASJC) codes

  • Biochemistry
  • Condensed Matter Physics
  • Physical and Theoretical Chemistry

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Lee, Choongkeun ; Maeng, Gloria ; Kim, Hae Won ; Sohlberg, Karl. / Quantum mechanical modeling of a tripodal [2]rotaxane and its binding to TiO2. In: Computational and Theoretical Chemistry. 2011 ; Vol. 966, No. 1-3. pp. 180-185.