(Salen)Mn(III) compound as a nonpeptidyl mimic of catalase: DFT study of the metal oxidation by a peroxide molecule

Journal of Physical Chemistry B

Volumn 108, Issue 8, 2004, Pages 2708-2711

  Abashkin, Yuri G ^a   Burt, Stanley K ^a  

^a SAIC FREDERICK INC   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION ENERGY; CATALYST ACTIVITY; CHEMICAL BONDS; ENZYMES; GROUND STATE; HYDROGEN PEROXIDE; MOLECULES; OXIDATION; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION; SURFACES; WATER;

CATALASE; CATALASE ACTIVITY; DISMUTATION; NONPEPTIDYL MIMIC;

MANGANESE COMPOUNDS;

EID: 1542305708     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp036905r     Document Type: Article

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