Solvation of anionic water-soluble porphyrins: A computational study

International Journal of Quantum Chemistry

Volumn 110, Issue 11, 2010, Pages 2094-2100

  Cuya Guizado, Teobaldo R ^a   Louro, Sonia R W ^a   Pascutt, Pedro G ^b   Anteneodo, Celia ^a,c  

^a PONTIFICAL CATHOLIC UNIVERSITY OF RIO DE JANEIRO   (Brazil)

^b FEDERAL UNIVERSITY OF RIO DE JANEIRO   (Brazil)

^c NATIONAL INSTITUTE OF SCIENCE AND TECHNOLOGY FOR COMPLEX SYSTEMS   (Brazil)

Author keywords

Hydropathicity; Molecular dynamics; Porphyrins; Radial distribution function

Indexed keywords

COMPUTATIONAL STUDIES; EXPLICIT SOLVENTS; HYDROPATHICITY; HYDROPHOBIC CHARACTER; RADIAL DISTRIBUTION FUNCTIONS; SIDE CHAINS; WATER MOLECULE; WATER-SOLUBLE PORPHYRIN;

DISTRIBUTION FUNCTIONS; MOLECULAR DYNAMICS;

PORPHYRINS;

EID: 77955125041     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.22700     Document Type: Conference Paper

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