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An integrated interdisciplinary approach to animal-free nanomaterial and chemical safety assessment. | ||
::home:: ::progress:: ::partners:: ::training:: ::about in3:: .:ESTIV home:. .:in3 twitter page:. | |||
The in3 project is funded by the EU's Marie Sklodowska-Curie Action - Innovative Training Network (MSCA-ITN for short) that aims to drive the synergistic development and utilisation of in vitro and in silico tools for human chemical and nanomaterial (NM) safety assessment. December 14th and 15th 2020 virtual meetingTo communicate with us please follow the link to our slack workspace [in3 Slack].
Introduction | |||
Here are our dedicated, motivated, dynamic, intelligent, smart, early stage researchers.
Coordinator: Prof. Dr. Paul Jennings p.jennings@vu.nl Training coordinator: Dr. Maxime Culot maxime.culot@univ-artois.fr Project manager: Dr. Ellen Langemeijer e.v.langemeijer@vu.nl ![]() ![]() ![]() | |||
The following are the in3 peer reviewed papers we have to date. But we have a lot more on the way and we will have a special issue soon in Toxicology in vitro. Homology Modeling of the Human P-glycoprotein (ABCB1) and Insights into Ligand Binding through Molecular Docking Studies. Mora Lagares L, Minovski N, Caballero Alfonso AY, Benfenati E, Wellens S, Culot M, Gosselet F, Novič M. Quantitative adverse outcome pathway (qAOP) models for toxicity prediction. Spinu, N., Cronin, M., Enoch, S. J., Madden, J. C., & Worth, A. P. (2020). Archives of toxicology, 94(5), 1497–1510. https://doi.org/10.1007/s00204-020-02774-7 SAR and QSAR modeling of a large collection of LD50 rat acute oral toxicity data.Gadaleta, D., Vuković, K., Toma, C. et al. SAR and J Cheminform 11, 58 (2019). https://doi.org/10.1186/s13321-019-0383-2 Methodology of aiQSAR: a group-specific approach to QSAR modelling. Vukovic K, Gadaleta D, Benfenati E. J Cheminform. 2019 Apr 3;11(1):27. doi: 10.1186/s13321-019-0350-y. PMID: 30945010 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. Chayawan Chayawan, Cosimo Toma, Emilio Benfenati, Ana Y Caballero Alfonso. DOI: 10.3390/molecules25030739 Spinu, N., Bal-Price, A., Cronin, M. T. D., Enoch, S. J., Madden, J. C., & Worth, A. P. (2019). Development and analysis of an adverse outcome pathway network for human neurotoxicity. Archives of Toxicology.
doi:10.1007/s00204-019-02551-1
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