Temperature Dependence of NMR Parameters Calculated from Path Integral Molecular Dynamics Simulations

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Martin Dračínský1, Petr Bouř1, Paul Hodgkinson2

  • 1Institute of Organic Chemistry and Biochemistry , Flemingovo nám. 2, 16610 Prague, Czech Republic.

Journal of Chemical Theory and Computation
|February 10, 2016
PubMed

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