| Abstract
| - Molecular quantum similarity is evaluated for enantiomers in the case of molecules showing conformationalflexibility, using our earlier proposed Boltzmann weighted similarity index. The conformers of the enantiomersof the amino acids alanine, asparagine, cysteine, leucine, serine, and valine were examined. Next to studyingglobal indices, the evaluation of local similarity is carried out using our earlier proposed local similarityindex based on the Hirshfeld partitioning, to further illustrate Mezey's holographic electron density theoremin chiral systems and to quantify dissimilarity of enantiomers.
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