Quantitative structure-activity relationship modeling of bioconcentration factors of polychlorinated biphenyls

Toxicological and Environmental Chemistry

Volumn 92, Issue 7, 2010, Pages 1233-1247

  Katritzky, Alan R ^a   Radzvilovits, Maksim ^a,b,c   Slavov, Svetoslav ^a   Kasemets, Kalev ^a,b,c   Tamm, Kaido ^b,c   Karelson, Mati ^b,d  

^a University of Florida ^*  (United States)

^b MolCode Ltd   (Estonia)

^c UNIVERSITY OF TARTU   (Estonia)

^d TALLINN UNIVERSITY OF TECHNOLOGY   (Estonia)

Author keywords

Bioconcentration factor; BMLR; Polychlorinated biphenyls; QSAR

Indexed keywords

BIOCONCENTRATION FACTOR; BIOLOGICAL TARGETS; CALCULATED VALUES; DESCRIPTORS; GENERAL MODEL; MOLECULAR DESCRIPTORS; MULTI-LINEAR REGRESSION; PREDICTIVE ABILITIES; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIP MODELING; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS; QUANTUM CHEMICAL; REGRESSION EQUATION; SPATIAL MASS; STATISTICAL ANALYSIS; STATISTICAL PARAMETERS; STATISTICAL VALIDATION; STRUCTURAL FLEXIBILITIES; TWO-PARAMETER MODELS;

CELL MEMBRANES; CYTOLOGY; ENVIRONMENTAL IMPACT; ORGANIC POLLUTANTS;

POLYCHLORINATED BIPHENYLS;

ALGORITHM; BIOACCUMULATION; CORRELATION; MODEL VALIDATION; PCB; SPATIAL DISTRIBUTION; THERMODYNAMICS; TOPOLOGY;

EID: 77954985770     PISSN: 02772248     EISSN: 10290486     Source Type: Journal    
DOI: 10.1080/02772240903306417     Document Type: Article

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