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An integrated interdisciplinary approach to animal-free chemical and nanomaterial safety assessment

Deliverables

Distribution of Recruitment advertisement and application form

Add recruitment advertisement and application form to the in3 web-page and other job searching services such as Nature Jobs.

Establish in3 web page

We will create the in3 website, which will facilitate both internal and external communication containing, description of the project, an ESR recruitment call, training programs, training material (slides from the courses, exercises), links to software, relevant training literature, FAQ on 3R-alternative methods or relevant websites e.g. Alttox.org, schedule of in3 events and information on the partners. P5 will be responsible for the technical organisation of webinars. The results of the project will be disseminated at local meetings and international conferences via poster presentations and oral communication. Results will be published in peer reviewed scientific journals. A yearly report summary will be generated and published online and disseminated to members of existing networks such as EUROTOX, ESTIV, SEURAT-1 and the EPAA (European partnership for alternatives approaches, a public-private partnership between European commission and the industry). A version of this will be translated and sent to local press agencies.

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Publications

Evaluation of a human iPSC-derived BBB model for repeated dose toxicity testing with cyclosporine A as model compound

Author(s): Sara Wellens, Lucie Dehouck, Vidya Chandrasekaran, Pranika Singh, Rodrigo Azevedo Loiola, Emmanuel Sevin, Thomas Exner, Paul Jennings, Fabien Gosselet, Maxime Culot
Published in: Toxicology in Vitro, Issue 73, 2021, Page(s) 105112, ISSN 0887-2333
DOI: 10.1016/j.tiv.2021.105112

Differentiation of human iPSCs into functional podocytes

Author(s): Caroline Rauch, Elisabeth Feifel, Georg Kern, Cormac Murphy, Florian Meier, Walther Parson, Mario Beilmann, Paul Jennings, Gerhard Gstraunthaler, Anja Wilmes
Published in: PLOS ONE, Issue 13/9, 2018, Page(s) e0203869, ISSN 1932-6203
DOI: 10.1371/journal.pone.0203869

Development and analysis of an adverse outcome pathway network for human neurotoxicity

Author(s): Nicoleta Spinu, Anna Bal-Price, Mark T. D. Cronin, Steven J. Enoch, Judith C. Madden, Andrew P. Worth
Published in: Archives of Toxicology, 2019, ISSN 0340-5761
DOI: 10.1007/s00204-019-02551-1

Ensemble-Based Modeling of Chemical Compounds with Antimalarial Activity

Author(s): Ana Yisel Caballero-Alfonso, Maykel Cruz-Monteagudo, Eduardo Tejera, Emilio Benfenati, Fernanda Borges, M. Natália D.S. Cordeiro, Vinicio Armijos-Jaramillo, Yunierkis Perez-Castillo
Published in: Current Topics in Medicinal Chemistry, Issue 19/11, 2019, Page(s) 957-969, ISSN 1568-0266
DOI: 10.2174/1568026619666190510100313

Multiclass Classifier for P-Glycoprotein Substrates, Inhibitors, and Non-Active Compounds

Author(s): Liadys Mora Lagares, Nikola Minovski, Marjana Novič
Published in: Molecules, Issue 24/10, 2019, Page(s) 2006, ISSN 1420-3049
DOI: 10.3390/molecules24102006

Homology Modeling of the Human P-glycoprotein (ABCB1) and Insights into Ligand Binding through Molecular Docking Studies

Author(s): Liadys Mora Lagares, Nikola Minovski, Ana Yisel Caballero Alfonso, Emilio Benfenati, Sara Wellens, Maxime Culot, Fabien Gosselet, Marjana Novič
Published in: International Journal of Molecular Sciences, Issue 21/11, 2020, Page(s) 4058, ISSN 1422-0067
DOI: 10.3390/ijms21114058

Methodology of aiQSAR: a group-specific approach to QSAR modelling

Author(s): Kristijan Vukovic, Domenico Gadaleta, Emilio Benfenati
Published in: Journal of Cheminformatics, Issue 11/1, 2019, ISSN 1758-2946
DOI: 10.1186/s13321-019-0350-y

Quantitative adverse outcome pathway (qAOP) models for toxicity prediction

Author(s): Nicoleta Spinu, Mark T. D. Cronin, Steven J. Enoch, Judith C. Madden, Andrew P. Worth
Published in: Archives of Toxicology, Issue 94/5, 2020, Page(s) 1497-1510, ISSN 0340-5761
DOI: 10.1007/s00204-020-02774-7

Towards an Understanding of the Mode of Action of Human Aromatase Activity for Azoles through Quantum Chemical Descriptors-Based Regression and Structure Activity Relationship Modeling Analysis

Author(s): Chayawan Chayawan, Cosimo Toma, Emilio Benfenati, Ana Y. Caballero Alfonso
Published in: Molecules, Issue 25/3, 2020, Page(s) 739, ISSN 1420-3049
DOI: 10.3390/molecules25030739