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Updated: Aug 29, 2026

Construction and Systematical Symmetric Studies of a Series of Supramolecular Clusters with Binary or Ternary Ammonium Triphenylacetates
Published on: February 15, 2016
e-molecular shapes and properties
A J M Carpy1, N Marchand-Geneste
1Laboratoire de Physico- et Toxico-Chimie des Systèmes Naturels, UMR 5472 CNRS, Université de Bordeaux 1, 351, Cours de la Libération 33405, Talence cedex, France. a.carpy@lptc.u-bordeaux1.fr
Abstract:
Due to recent computer technology advances, shape analysis has gained importance in all domains. In drug design and proteomics, molecular surfaces (van der Waals surface, solvent accessible surface, solvent excluded surface, polar surface area, electron density surface, separating surface, etc.), buried surfaces (gap, cleft, cavity, etc.) as well as shape properties of these surfaces, can be easily computed and visualized via the Internet. Freely available resources from the Internet for academic use, are reviewed.
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