Intermolecular accessibility: the meaning of molecular connectivity |
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| Authors: | Kier Hall |
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| Institution: | Department of Medicinal Chemistry, Virginia Commonwealth University, Richmond 23298, USA. |
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| Abstract: | The molecular connectivity indices are shown to be the numerical possibilities of a molecule encountering another identical molecule, derived from the bond accessibilites of each. The meaning of the delta values and the significance of all suppressed X-H bonds is described. A new concept of the meaning of molecular connectivity, built around bimolecular encounter accessibility, is presented. |
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