Molecular modeling utilizing purple acid phosphatase biomimetic models

Canadian Journal of Chemistry

Volumn 82, Issue 11, 2004, Pages 1619-1624

  Paes, Lilian W ^a   Faria, Roberto B ^a   Machuca Herrera, Juan O ^a   Neves, Ademir ^b   Machado, Sérgio P ^a  

^a FEDERAL UNIVERSITY OF RIO DE JANEIRO   (Brazil)

^b FEDERAL UNIVERSITY OF SANTA CATARINA   (Brazil)

Author keywords

Mixed valence FeIIFeIII complex; Molecular modeling; Purple acid phosphatases

Indexed keywords

BIOMIMETIC MATERIALS; CHARGE TRANSFER; ELECTRON TRANSITIONS; HYDROLYSIS; IRON; PHOSPHATES; QUANTUM THEORY;

ATOMIC ORBITAL ANALYSIS; METALLOENZYMES; MOLECULAR MECHANICS; VIBRATIONAL PARAMETERS;

ENZYMES;

2 BIS[[(2 PYRIDYLMETHYL)AMINOMETHYL] 6 [(2 HYDROXYBENZYL)(2 PYRIDYLMETHYL)]AMINOMETHYL] 2 METHYLPHENOL; ACID PHOSPHATASE TARTRATE RESISTANT ISOENZYME; AMINE; BIOMIMETIC MATERIAL; ENZYME; IMIDAZOLE DERIVATIVE; IRON; LIGAND; METALLOPROTEIN; NUCLEOSIDE TRIPHOSPHATE; ORGANOPHOSPHATE; POLYCYCLIC AROMATIC HYDROCARBON DERIVATIVE; PYRIDINE DERIVATIVE; UNCLASSIFIED DRUG;

ARTICLE; CALCULATION; CATALYST; HYDROLYSIS; MOLECULAR MECHANICS; MOLECULAR MODEL; QUANTUM CHEMISTRY;

EID: 14744290946     PISSN: 00084042     EISSN: None     Source Type: Journal    
DOI: 10.1139/v04-134     Document Type: Article

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