Utilizing hirshfeld surface calculations, non-covalent inter­action (nci) plots and the calculation of inter­action energies in the analysis of mol­ecular packing

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• who: Utilizing Hirshfeld surface calculations and colleagues from the Research Centre for Crystalline Materials, School of Science and Technology, Sunway University, Bandar have published the Article: Utilizing Hirshfeld surface calculations, non-covalent inter­action (NCI) plots and the calculation of inter­action energies in the analysis of mol­ecular packing, in the Journal: (JOURNAL)
• what: This analysis is often extended into the highly popular supramolecular synthon approach (Desiraju, 1995), whereby residue-to-residue contacts are evaluated as exemplified in the familiar eight-membered carboxylic acid synthon, i.e. { HOCO}2. Two in particular form the . . .
  

   

  

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