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- W2010421708 abstract "The concept of the generation of molecular structures directly from a QSAR equation using topological indices is presented. The equations relating the path counts to the graph atom degree counts is presented as a linkage in the flow of information. The multiple candidate molecules are derived from target indices using a quality QSAR equation. An example is developed to illustrate the process using molecular connectivity indices." @default.
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- W2010421708 date "1993-01-01" @default.
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- W2010421708 title "The Generation of Molecular Structures from a Graph-Based QSAR Equation" @default.
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- W2010421708 doi "https://doi.org/10.1002/qsar.19930120406" @default.
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