Mechanistic quantitative structure-activity relationship model for the photoinduced toxicity of polycyclic aromatic hydrocarbons: I. Physical model based on chemical kinetics in a two-compartment system

Sergey N. Krylov; Xiao-Dong Huang; Lorelei F. Zeiler; D. George Dixon; Bruce M. Greenberg

doi:10.1002/etc.5620161113

Mechanistic quantitative structure-activity relationship model for the photoinduced toxicity of polycyclic aromatic hydrocarbons: I. Physical model based on chemical kinetics in a two-compartment system

Environmental Toxicology and Chemistry ◽

10.1002/etc.5620161113 ◽

1997 ◽

Vol 16 (11) ◽

pp. 2283-2295 ◽

Cited By ~ 1

Author(s):

Sergey N. Krylov ◽

Xiao-Dong Huang ◽

Lorelei F. Zeiler ◽

D. George Dixon ◽

Bruce M. Greenberg

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Physical Model ◽

Chemical Kinetics ◽

Aromatic Hydrocarbons ◽

Quantitative Structure Activity Relationship ◽

Quantitative Structure ◽

Compartment System ◽

Structure Activity ◽

Relationship Model ◽

Polycyclic Aromatic

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MECHANISTIC QUANTITATIVE STRUCTURE–ACTIVITY RELATIONSHIP MODEL FOR THE PHOTOINDUCED TOXICITY OF POLYCYCLIC AROMATIC HYDROCARBONS: I. PHYSICAL MODEL BASED ON CHEMICAL KINETICS IN A TWO-COMPARTMENT SYSTEM

Environmental Toxicology and Chemistry ◽

10.1897/1551-5028(1997)016<2283:mqsarm>2.3.co;2 ◽

1997 ◽

Vol 16 (11) ◽

pp. 2283 ◽

Cited By ~ 1

Author(s):

Sergey N. Krylov ◽

Xiao-Dong Huang ◽

Lorelei F. Zeiler ◽

D. George Dixon ◽

Bruce M. Greenberg

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Physical Model ◽

Chemical Kinetics ◽

Aromatic Hydrocarbons ◽

Quantitative Structure Activity Relationship ◽

Quantitative Structure ◽

Compartment System ◽

Structure Activity ◽

Relationship Model ◽

Polycyclic Aromatic

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Mechanistic quantitative structure-activity relationship model for the photoinduced toxicity of polycyclic aromatic hydrocarbons: II. An empirical model for the toxicity of 16 polycyclic aromatic hydrocarbons to the duckweedLemna gibbaL. G-3

Environmental Toxicology and Chemistry ◽

10.1002/etc.5620161114 ◽

1997 ◽

Vol 16 (11) ◽

pp. 2296-2303

Author(s):

Xiao-Dong Huang ◽

Sergey N. Krylov ◽

Lisha Ren ◽

Brendan J. McConkey ◽

D. George Dixon ◽

...

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Empirical Model ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Activity Relationship ◽

Quantitative Structure ◽

Structure Activity ◽

Relationship Model ◽

Polycyclic Aromatic

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MECHANISTIC QUANTITATIVE STRUCTURE–ACTIVITY RELATIONSHIP MODEL FOR THE PHOTOINDUCED TOXICITY OF POLYCYCLIC AROMATIC HYDROCARBONS: II. AN EMPIRICAL MODEL FOR THE TOXICITY OF 16 POLYCYCLIC AROMATIC HYDROCARBONS TO THE DUCKWEED LEMNA GIBBA L. G-3

Environmental Toxicology and Chemistry ◽

10.1897/1551-5028(1997)016<2296:mqsarm>2.3.co;2 ◽

1997 ◽

Vol 16 (11) ◽

pp. 2296 ◽

Cited By ~ 2

Author(s):

Xiao-Dong Huang ◽

Sergey N. Krylov ◽

Lisha Ren ◽

Brendan J. McConkey ◽

D. George Dixon ◽

...

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Empirical Model ◽

Quantitative Structure Activity Relationship ◽

Activity Relationship ◽

Lemna Gibba ◽

Quantitative Structure ◽

Structure Activity ◽

Relationship Model ◽

Polycyclic Aromatic

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A PREDICTIVE QUANTITATIVE STRUCTURE–ACTIVITY RELATIONSHIP MODEL FOR THE PHOTOINDUCED TOXICITY OF POLYCYCLIC AROMATIC HYDROCARBONS TO DAPHNIA MAGNA WITH THE USE OF FACTORS FOR PHOTOSENSITIZATION AND PHOTOMODIFICATION

Environmental Toxicology and Chemistry ◽

10.1897/06-295r.1 ◽

2007 ◽

Vol 26 (3) ◽

pp. 406 ◽

Cited By ~ 12

Author(s):

Mark A. Lampi ◽

Jolanta Gurska ◽

Xiao-Dong Huang ◽

D. George Dixon ◽

Bruce M. Greenberg

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Daphnia Magna ◽

Aromatic Hydrocarbons ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Activity Relationship ◽

Quantitative Structure ◽

Structure Activity ◽

Relationship Model ◽

Polycyclic Aromatic

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Simplified Molecular Input Line Entry System-Based Optimal Descriptors: Quantitative Structure-Activity Relationship Modeling Mutagenicity of Nitrated Polycyclic Aromatic Hydrocarbons

Chemical Biology & Drug Design ◽

10.1111/j.1747-0285.2009.00802.x ◽

2009 ◽

Vol 73 (5) ◽

pp. 515-525 ◽

Cited By ~ 13

Author(s):

Andrey A. Toropov ◽

Alla P. Toropova ◽

Emilio Benfenati

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Activity Relationship ◽

Quantitative Structure ◽

Input Line ◽

Nitrated Polycyclic Aromatic Hydrocarbons ◽

Structure Activity ◽

Polycyclic Aromatic

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QUANTITATIVE STRUCTURE–ACTIVITY RELATIONSHIP FOR THE PHOTOINDUCED TOXICITY OF POLYCYCLIC AROMATIC HYDROCARBONS TO THE LUMINESCENT BACTERIA VIBRIO FISCHERI

Environmental Toxicology and Chemistry ◽

10.1897/1551-5028(2002)021<2225:qsarft>2.0.co;2 ◽

2002 ◽

Vol 21 (10) ◽

pp. 2225 ◽

Cited By ~ 1

Author(s):

Yousef S. El-Alawi ◽

Xiao-Dong Huang ◽

D. George Dixon ◽

Bruce M. Greenberg

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Vibrio Fischeri ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Activity Relationship ◽

Quantitative Structure ◽

Structure Activity ◽

Luminescent Bacteria ◽

Polycyclic Aromatic

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Quantitative structure-activity relationship for the photoinduced toxicity of polycyclic aromatic hydrocarbons to the luminescent bacteriaVibrio fischeri

Environmental Toxicology and Chemistry ◽

10.1002/etc.5620211029 ◽

2002 ◽

Vol 21 (10) ◽

pp. 2225-2232 ◽

Cited By ~ 5

Author(s):

Yousef S. El-Alawi ◽

Xiao-Dong Huang ◽

D. George Dixon ◽

Bruce M. Greenberg

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Quantitative Structure Activity Relationship ◽

Structure Activity Relationship ◽

Activity Relationship ◽

Quantitative Structure ◽

Structure Activity ◽

Photoinduced Toxicity ◽

Polycyclic Aromatic

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Quantitative structure–activity relationship (QSAR) models for polycyclic aromatic hydrocarbons (PAHs) dissipation in rhizosphere based on molecular structure and effect size

Environmental Pollution ◽

10.1016/j.envpol.2010.04.011 ◽

2010 ◽

Vol 158 (8) ◽

pp. 2773-2777 ◽

Cited By ~ 17

Author(s):

Bin Ma ◽

Huaihai Chen ◽

Minmin Xu ◽

Tahir Hayat ◽

Yan He ◽

...

Keyword(s):

Molecular Structure ◽

Polycyclic Aromatic Hydrocarbons ◽

Aromatic Hydrocarbons ◽

Effect Size ◽

Quantitative Structure Activity Relationship ◽

Activity Relationship ◽

Quantitative Structure ◽

Structure Activity ◽

Polycyclic Aromatic ◽

Qsar Models

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Quantitative Structure-Activity Relationship (QSAR) Analysis Using the Partial Least Squares (PLS) Method: The Binding of Polycyclic Aromatic Hydrocarbons (PAH) to the Rat Liver 2,3,7,8-Tetrachlorodibenzo-P-Dioxin (TCDD) Receptor

Quantitative Structure-Activity Relationships ◽

10.1002/qsar.19890080202 ◽

1989 ◽

Vol 8 (2) ◽

pp. 83-89 ◽

Cited By ~ 8

Author(s):

Dan Johnels ◽

Mikael Gillner ◽

Bo NordÃ©n ◽

Rune ToftgÃ¥rd ◽

Jan-Ã¥ke Gustafsson

Keyword(s):

Polycyclic Aromatic Hydrocarbons ◽

Least Squares ◽

Partial Least Squares ◽

Aromatic Hydrocarbons ◽

Quantitative Structure Activity Relationship ◽

Quantitative Structure ◽

Qsar Analysis ◽

Structure Activity ◽

Polycyclic Aromatic ◽

Pls Method

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Polycyclic aromatic hydrocarbons quantitative structure–activity relationship model based on quantum chemical parameters through density functional theory

Human Health and Medical Engineering ◽

10.2495/hhme130811 ◽

2014 ◽

Author(s):

Yu Li ◽

Xiaoyu Cai ◽

Yaling Zeng ◽

Long Jiang

Keyword(s):

Aromatic Hydrocarbons ◽

Quantum Chemical ◽

Density Functional ◽

Quantitative Structure Activity Relationship ◽

Chemical Parameters ◽

Functional Theory ◽

Quantum Chemical Parameters ◽

Structure Activity ◽

Relationship Model ◽

Polycyclic Aromatic

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