Browsing by Subject "ZINC SUPEROXIDE-DISMUTASE"

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    • A Computationally Efficient and Reliable Bond Order Measure 
      Mera, Raúl; Mendizábal Emaldía, Fernando; Olea Azar, Claudio; Miranda Rojas, Sebastián; Fuentealba Rosas, Patricio (AMER CHEMICAL SOC, 2011-05-05)
      Bond order indexes are useful measures that connect quantum mechanical results with chemical understanding. One of these measures, the natural bond order index, based on the natural resonance theory procedure and part of ...