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Optimized and parallelized implementation of the electronegativity equalization method and the atom-bond electronegativity equalization method

Radka Svobodová Vareková, Jaroslav Koca. Optimized and parallelized implementation of the electronegativity equalization method and the atom-bond electronegativity equalization method. Journal of Computational Chemistry, 27(3):396-405, 2006. [doi]

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