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Energy of protonation

Definition:

EMH quantum-chemically calculated energy of neutral molecular species

EMH+ quantum-chemically calculated energy of protonated species

EH+ energy of proton in the given reference system

Reference:

  1. G. Trapani, A. Carotti, M. Franco, A. Latrofa, G. Genchi, G. Liso, G. Eur. J. Med. Chem., 1993, 28, 13

 

 
   
 
   
University of Florida 2001.
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