{"id":987,"date":"2022-10-01T21:42:38","date_gmt":"2022-10-01T21:42:38","guid":{"rendered":"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/?page_id=987"},"modified":"2023-10-16T16:33:59","modified_gmt":"2023-10-16T16:33:59","slug":"modeling-of-pfas","status":"publish","type":"page","link":"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/modeling-of-pfas\/","title":{"rendered":"Modeling of PFAS"},"content":{"rendered":"<div id=\"pl-987\"  class=\"panel-layout\" ><div id=\"pg-987-0\"  class=\"panel-grid panel-has-style\" ><div class=\"panel-row-style panel-row-style-for-987-0\" ><div id=\"pgc-987-0-0\"  class=\"panel-grid-cell\" ><div id=\"panel-987-0-0-0\" class=\"so-panel widget widget_text panel-first-child panel-last-child\" data-index=\"0\" ><h3 class=\"widget-title\">Modeling of PFAS Mixture Toxicity<\/h3>\t\t\t<div class=\"textwidget\"><p><strong>Principal Investigator(s): <\/strong>Dr. Marisol Sep\u00falveda<\/p>\n<\/div>\n\t\t<\/div><\/div><div id=\"pgc-987-0-1\"  class=\"panel-grid-cell\" ><div id=\"panel-987-0-1-0\" class=\"so-panel widget widget_media_image panel-first-child panel-last-child\" data-index=\"1\" ><div class=\"panel-widget-style panel-widget-style-for-987-0-1-0\" ><img loading=\"lazy\" decoding=\"async\" width=\"1077\" height=\"492\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/graphed.png\" class=\"image wp-image-1077  attachment-full size-full\" alt=\"Object graphic\" style=\"max-width: 100%; height: auto;\" srcset=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/graphed.png 1077w, https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/graphed-300x137.png 300w, https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/graphed-1024x468.png 1024w, https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/graphed-768x351.png 768w\" sizes=\"auto, (max-width: 1077px) 100vw, 1077px\" \/><\/div><\/div><\/div><\/div><\/div><div id=\"pg-987-1\"  class=\"panel-grid panel-no-style\" ><div id=\"pgc-987-1-0\"  class=\"panel-grid-cell\" ><div class=\"panel-cell-style panel-cell-style-for-987-1-0\" ><div id=\"panel-987-1-0-0\" class=\"so-panel widget widget_text panel-first-child panel-last-child\" data-index=\"2\" >\t\t\t<div class=\"textwidget\"><h3>Researchers<\/h3>\n<p style=\"text-align: center;margin: 0px 5px 30px 4px\"><img loading=\"lazy\" decoding=\"async\" class=\"aligncenter wp-image-1439\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/12\/choi-y-h250.jpg\" alt=\"Y. Choi\" width=\"192\" height=\"240\" \/>Youn Jeong Choi, Analytical Chemist<br \/>\nPurdue Agronomy<\/p>\n<p><img loading=\"lazy\" decoding=\"async\" class=\"size-full wp-image-1186 aligncenter\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/hoskins-tyler.png\" alt=\"Tyler Hoskins\" width=\"200\" height=\"250\" \/><\/p>\n<p style=\"text-align: center;margin: 0px 5px 30px 4px\">Tyler Hoskins, Research Assistant Faculty<br \/>\nPurdue FNR<\/p>\n<p><img loading=\"lazy\" decoding=\"async\" class=\"size-full wp-image-1187 aligncenter\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/hoverman-jason.jpg\" alt=\"Dr. Jason Hoverman\" width=\"200\" height=\"250\" \/><\/p>\n<p style=\"text-align: center;margin: 0px 5px 30px 4px\">Jason Hoverman, Professor<br \/>\nPurdue FNR<\/p>\n<p><img loading=\"lazy\" decoding=\"async\" class=\"aligncenter wp-image-1188\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/linda-lee-250h.jpg\" alt=\"Linda Lee\" width=\"151\" height=\"211\" \/><\/p>\n<p style=\"text-align: center;margin: 0px 5px 30px 4px\">Linda Lee, Professor<br \/>\nPurdue Environmental and Ecological Engineering &amp; Agronomy<\/p>\n<\/div>\n\t\t<\/div><\/div><\/div><div id=\"pgc-987-1-1\"  class=\"panel-grid-cell\" ><div class=\"panel-cell-style panel-cell-style-for-987-1-1\" ><div id=\"panel-987-1-1-0\" class=\"so-panel widget widget_text panel-first-child panel-last-child\" data-index=\"3\" >\t\t\t<div class=\"textwidget\"><p><img loading=\"lazy\" decoding=\"async\" class=\"aligncenter wp-image-1283\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/10\/kar-supratik-250h.jpg\" alt=\"Supratik Kar\" width=\"169\" height=\"211\" \/><\/p>\n<p style=\"text-align: center;margin: 0px 5px 30px 4px\">S. Kar, Professor at Dorothy &amp; George Hennings College of Science<br \/>\nKean University, NJ<\/p>\n<p><img loading=\"lazy\" decoding=\"async\" class=\"size-full wp-image-1287 aligncenter\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/10\/gantz-j-2-250h.jpg\" alt=\"J.D. Gantz\" width=\"200\" height=\"250\" \/><\/p>\n<p style=\"text-align: center;margin: 0px 5px 30px 4px\">J.D. Gantz, Morris &amp; Ann Henry Odyssey Assistant Professor of Biology<br \/>\nHendrix College, Arizona<\/p>\n<p><img loading=\"lazy\" decoding=\"async\" class=\"size-full wp-image-1409 aligncenter\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/11\/Sepulveda-UP-Michigan-May-2022.jpg\" alt=\"Dr. Marisol Sepulvada holding a fish.\" width=\"200\" height=\"250\" \/><\/p>\n<p style=\"text-align: center;margin: 0px 5px 30px 4px\">Marisol Sep\u00falveda, Professor and Associate Head of Research<br \/>\nPurdue Forestry &amp; Natural Resources<\/p>\n<\/div>\n\t\t<\/div><\/div><\/div><div id=\"pgc-987-1-2\"  class=\"panel-grid-cell\" ><div class=\"panel-cell-style panel-cell-style-for-987-1-2\" ><div id=\"panel-987-1-2-0\" class=\"so-panel widget widget_text panel-first-child\" data-index=\"4\" >\t\t\t<div class=\"textwidget\"><h3>Research Objectives<\/h3>\n<p>Environmental exposure to per and polyfluoroalkyl substances (PFAS) occurs as mixtures. Importantly, the bioaccumulation potential and toxicity of a particular mixture is driven by the number of halogenated carbons and functional groups present. PFAS are also highly proteinophilic and known to bind to proteins. Hemoglobins (Hbs) are key proteins responsible for transporting oxygen to tissues and studies show PFAS can bind with Hb interfering with oxygen transport. Chironomids (midges) are highly sensitive to PFAS and &gt;95% of all their hemolymph proteins are Hbs. Using a combination of in silico, in vitro, and in vivo tools, we will test the overarching hypothesis that binding of PFAS to Hbs is a tractable and sensitive physiological signal for predicting the toxicity of PFAS mixtures.<\/p>\n<ul>\n<li>Develop and parameterize mechanistic toxicity in silico models to determine whether the toxicity of PFAS mixtures deviates from additivity<\/li>\n<li>Inform and validate in silico models using PFAS and Hb binding affinity data<\/li>\n<li>Inform and validate in silico models using in vivo toxicity tests<\/li>\n<\/ul>\n<\/div>\n\t\t<\/div><div id=\"panel-987-1-2-1\" class=\"widget_text so-panel widget widget_custom_html panel-last-child\" data-index=\"5\" ><div class=\"textwidget custom-html-widget\"><a href=\"https:\/\/www.epa.gov\/\" target=\"_blank\" rel=\"noopener\"><img loading=\"lazy\" decoding=\"async\" class=\"aligncenter size-full wp-image-1079\" style=\"padding-bottom:30px\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/Picture47.jpg\" alt=\"United States Envrionmental Protection Agency\" width=\"187\" height=\"176\" \/><\/a>\n\n<a href=\"https:\/\/www.hendrix.edu\/\" target=\"_blank\" rel=\"noopener\"><img loading=\"lazy\" decoding=\"async\" class=\"aligncenter size-full wp-image-1078\" style=\"padding-bottom:30px\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/Picture49.png\" alt=\"Hendrix College\" width=\"248\" height=\"55\" \/><\/a>\n\n<a href=\"https:\/\/www.kean.edu\/\" target=\"_blank\" rel=\"noopener\"><img loading=\"lazy\" decoding=\"async\" class=\"aligncenter size-full wp-image-1080\" style=\"padding-bottom:30px\" src=\"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-content\/uploads\/sites\/5\/2022\/09\/Picture48.png\" alt=\"Kean University\" width=\"127\" height=\"121\" \/><\/a><\/div><\/div><\/div><\/div><\/div><\/div>","protected":false},"excerpt":{"rendered":"<p>Principal Investigator(s): Dr. Marisol Sep\u00falveda Researchers Youn Jeong Choi, Analytical Chemist Purdue Agronomy Tyler Hoskins, Research Assistant Faculty Purdue FNR Jason Hoverman, Professor Purdue FNR Linda Lee, Professor Purdue Environmental and Ecological Engineering &amp; Agronomy S. Kar, Professor at Dorothy<\/p>\n","protected":false},"author":55,"featured_media":0,"parent":0,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"footnotes":""},"class_list":["post-987","page","type-page","status-publish","hentry"],"_links":{"self":[{"href":"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-json\/wp\/v2\/pages\/987","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-json\/wp\/v2\/pages"}],"about":[{"href":"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-json\/wp\/v2\/types\/page"}],"author":[{"embeddable":true,"href":"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-json\/wp\/v2\/users\/55"}],"replies":[{"embeddable":true,"href":"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-json\/wp\/v2\/comments?post=987"}],"version-history":[{"count":22,"href":"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-json\/wp\/v2\/pages\/987\/revisions"}],"predecessor-version":[{"id":1742,"href":"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-json\/wp\/v2\/pages\/987\/revisions\/1742"}],"wp:attachment":[{"href":"https:\/\/www.purdue.edu\/fnr\/sites\/sepulveda\/wp-json\/wp\/v2\/media?parent=987"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}