Proposal of a simple and effective local reactivity descriptor through a topological analysis of an orbital-weighted fukui function

Ricardo Pino-Rios, Osvaldo Yañez, Diego Inostroza, Lina Ruiz, Carlos Cardenas, Patricio Fuentealba, William Tiznado. Proposal of a simple and effective local reactivity descriptor through a topological analysis of an orbital-weighted fukui function. Journal of Computational Chemistry, 38(8):481-488, 2017. [doi]

Authors

Ricardo Pino-Rios

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Osvaldo Yañez

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Diego Inostroza

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Lina Ruiz

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Carlos Cardenas

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Patricio Fuentealba

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William Tiznado

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