Molecular topological index: An application in the QSAR study of toxicity of alcohols |
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| Authors: | Albin Jurić Mirko Gagro Sonja Nikolić Nenad Trinajstić |
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| Institution: | (1) Chemistry Department, Agricultural Institute, 43260 Kri evci, The Republic of Croatia;(2) The Rugjer Bo kovi Institute, P.O. Box 1016, 41001 Zagreb, The Republic of Croatia |
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| Abstract: | An application of the molecular topological index, adapted for heterosystems, in the QSAR study of toxicity of alkyl alcohols on fathead minnows (Pimephates promelas) is examined. The obtained QSAR model is comparable to models based on the Wiener number and the connectivity index. |
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