Application of Bayesian Population Physiologically Based Pharmacokinetic (PBPK) Modeling and Markov Chain Monte Carlo Simulations to Pesticide Kinetics Studies in Protected Marine Mammals: DDT, DDE, and DDD in Harbor Porpoises

peer reviewed Physiologically based pharmacokinetic (PBPK) modeling in marine mammals is a challenge because of the lack of parameter information and the ban on exposure experiments. To minimize uncertainty and variability, parameter estimation methods are required for the development of reliable PB...

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Published in:Environmental Science & Technology
Main Authors: Weijs, Liesbeth, Yang, Raymond S.H., Das, Krishna, Covaci, Adrian, Blust, Ronny
Other Authors: MARE - Centre Interfacultaire de Recherches en Océanologie - ULiège
Format: Article in Journal/Newspaper
Language:English
Published: American Chemical Society 2013
Subjects:
DDT
Online Access:https://orbi.uliege.be/handle/2268/149301
https://doi.org/10.1021/es400386a
id ftorbi:oai:orbi.ulg.ac.be:2268/149301
record_format openpolar
spelling ftorbi:oai:orbi.ulg.ac.be:2268/149301 2024-11-10T14:39:19+00:00 Application of Bayesian Population Physiologically Based Pharmacokinetic (PBPK) Modeling and Markov Chain Monte Carlo Simulations to Pesticide Kinetics Studies in Protected Marine Mammals: DDT, DDE, and DDD in Harbor Porpoises Weijs, Liesbeth Yang, Raymond S.H. Das, Krishna Covaci, Adrian Blust, Ronny MARE - Centre Interfacultaire de Recherches en Océanologie - ULiège 2013 https://orbi.uliege.be/handle/2268/149301 https://doi.org/10.1021/es400386a en eng American Chemical Society urn:issn:0013-936X urn:issn:1520-5851 https://orbi.uliege.be/handle/2268/149301 info:hdl:2268/149301 doi:10.1021/es400386a info:pmid:23560461 restricted access http://purl.org/coar/access_right/c_16ec info:eu-repo/semantics/restrictedAccess Environmental Science and Technology, 47, 4365-4374 (2013) marine mammals pollutants harbour porpoise DDT Phocoena phocoena PBPK physiologically based pharmacokinetic modeling Black Sea Life sciences Aquatic sciences & oceanology Sciences du vivant Sciences aquatiques & océanologie journal article http://purl.org/coar/resource_type/c_6501 info:eu-repo/semantics/article peer reviewed 2013 ftorbi https://doi.org/10.1021/es400386a 2024-10-21T15:24:54Z peer reviewed Physiologically based pharmacokinetic (PBPK) modeling in marine mammals is a challenge because of the lack of parameter information and the ban on exposure experiments. To minimize uncertainty and variability, parameter estimation methods are required for the development of reliable PBPK models. The present study is the first to develop PBPK models for the lifetime bioaccumulation of p,p′-DDT, p,p′-DDE, and p,p′- DDD in harbor porpoises. In addition, this study is also the first to apply the Bayesian approach executed with Markov chain Monte Carlo simulations using two data sets of harbor porpoises from the Black and North Seas. Parameters from the literature were used as priors for the first “model update” using the Black Sea data set, the resulting posterior parameters were then used as priors for the second “model update” using the North Sea data set. As such, PBPK models with parameters specific for harbor porpoises could be strengthened with more robust probability distributions. As the science and biomonitoring effort progress in this area, more data sets will become available to further strengthen and update the parameters in the PBPK models for harbor porpoises as a species anywhere in the world. Further, such an approach could very well be extended to other protected marine mammals. Article in Journal/Newspaper Harbour porpoise Phocoena phocoena University of Liège: ORBi (Open Repository and Bibliography) Environmental Science & Technology 47 9 4365 4374
institution Open Polar
collection University of Liège: ORBi (Open Repository and Bibliography)
op_collection_id ftorbi
language English
topic marine mammals
pollutants
harbour porpoise
DDT
Phocoena phocoena
PBPK
physiologically based pharmacokinetic modeling
Black Sea
Life sciences
Aquatic sciences & oceanology
Sciences du vivant
Sciences aquatiques & océanologie
spellingShingle marine mammals
pollutants
harbour porpoise
DDT
Phocoena phocoena
PBPK
physiologically based pharmacokinetic modeling
Black Sea
Life sciences
Aquatic sciences & oceanology
Sciences du vivant
Sciences aquatiques & océanologie
Weijs, Liesbeth
Yang, Raymond S.H.
Das, Krishna
Covaci, Adrian
Blust, Ronny
Application of Bayesian Population Physiologically Based Pharmacokinetic (PBPK) Modeling and Markov Chain Monte Carlo Simulations to Pesticide Kinetics Studies in Protected Marine Mammals: DDT, DDE, and DDD in Harbor Porpoises
topic_facet marine mammals
pollutants
harbour porpoise
DDT
Phocoena phocoena
PBPK
physiologically based pharmacokinetic modeling
Black Sea
Life sciences
Aquatic sciences & oceanology
Sciences du vivant
Sciences aquatiques & océanologie
description peer reviewed Physiologically based pharmacokinetic (PBPK) modeling in marine mammals is a challenge because of the lack of parameter information and the ban on exposure experiments. To minimize uncertainty and variability, parameter estimation methods are required for the development of reliable PBPK models. The present study is the first to develop PBPK models for the lifetime bioaccumulation of p,p′-DDT, p,p′-DDE, and p,p′- DDD in harbor porpoises. In addition, this study is also the first to apply the Bayesian approach executed with Markov chain Monte Carlo simulations using two data sets of harbor porpoises from the Black and North Seas. Parameters from the literature were used as priors for the first “model update” using the Black Sea data set, the resulting posterior parameters were then used as priors for the second “model update” using the North Sea data set. As such, PBPK models with parameters specific for harbor porpoises could be strengthened with more robust probability distributions. As the science and biomonitoring effort progress in this area, more data sets will become available to further strengthen and update the parameters in the PBPK models for harbor porpoises as a species anywhere in the world. Further, such an approach could very well be extended to other protected marine mammals.
author2 MARE - Centre Interfacultaire de Recherches en Océanologie - ULiège
format Article in Journal/Newspaper
author Weijs, Liesbeth
Yang, Raymond S.H.
Das, Krishna
Covaci, Adrian
Blust, Ronny
author_facet Weijs, Liesbeth
Yang, Raymond S.H.
Das, Krishna
Covaci, Adrian
Blust, Ronny
author_sort Weijs, Liesbeth
title Application of Bayesian Population Physiologically Based Pharmacokinetic (PBPK) Modeling and Markov Chain Monte Carlo Simulations to Pesticide Kinetics Studies in Protected Marine Mammals: DDT, DDE, and DDD in Harbor Porpoises
title_short Application of Bayesian Population Physiologically Based Pharmacokinetic (PBPK) Modeling and Markov Chain Monte Carlo Simulations to Pesticide Kinetics Studies in Protected Marine Mammals: DDT, DDE, and DDD in Harbor Porpoises
title_full Application of Bayesian Population Physiologically Based Pharmacokinetic (PBPK) Modeling and Markov Chain Monte Carlo Simulations to Pesticide Kinetics Studies in Protected Marine Mammals: DDT, DDE, and DDD in Harbor Porpoises
title_fullStr Application of Bayesian Population Physiologically Based Pharmacokinetic (PBPK) Modeling and Markov Chain Monte Carlo Simulations to Pesticide Kinetics Studies in Protected Marine Mammals: DDT, DDE, and DDD in Harbor Porpoises
title_full_unstemmed Application of Bayesian Population Physiologically Based Pharmacokinetic (PBPK) Modeling and Markov Chain Monte Carlo Simulations to Pesticide Kinetics Studies in Protected Marine Mammals: DDT, DDE, and DDD in Harbor Porpoises
title_sort application of bayesian population physiologically based pharmacokinetic (pbpk) modeling and markov chain monte carlo simulations to pesticide kinetics studies in protected marine mammals: ddt, dde, and ddd in harbor porpoises
publisher American Chemical Society
publishDate 2013
url https://orbi.uliege.be/handle/2268/149301
https://doi.org/10.1021/es400386a
genre Harbour porpoise
Phocoena phocoena
genre_facet Harbour porpoise
Phocoena phocoena
op_source Environmental Science and Technology, 47, 4365-4374 (2013)
op_relation urn:issn:0013-936X
urn:issn:1520-5851
https://orbi.uliege.be/handle/2268/149301
info:hdl:2268/149301
doi:10.1021/es400386a
info:pmid:23560461
op_rights restricted access
http://purl.org/coar/access_right/c_16ec
info:eu-repo/semantics/restrictedAccess
op_doi https://doi.org/10.1021/es400386a
container_title Environmental Science & Technology
container_volume 47
container_issue 9
container_start_page 4365
op_container_end_page 4374
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