A chemoinformatics approach for the characterization of hybrid nanomaterials: safer and efficient design perspective

Author:

Mikolajczyk Alicja12345ORCID,Sizochenko Natalia12345ORCID,Mulkiewicz Ewa62345ORCID,Malankowska Anna72345ORCID,Rasulev Bakhtiyor891011ORCID,Puzyn Tomasz12345ORCID

Affiliation:

1. Laboratory of Environmental Chemometrics

2. Faculty of Chemistry

3. University of Gdansk

4. 80-308 Gdansk

5. Poland

6. Department of Environmental Analytics

7. Department of Environmental Technology

8. Department of Coatings and Polymeric Materials

9. North Dakota State University

10. Fargo

11. USA

Abstract

In this study, photocatalytic properties and in vitro cytotoxicity of newly designed 29 hybrid TiO2-based nanomaterials were evaluated using a combination of the experimental testing and machine learning modeling.

Funder

Narodowe Centrum Nauki

Horizon 2020 Framework Programme

Office of Experimental Program to Stimulate Competitive Research

Publisher

Royal Society of Chemistry (RSC)

Subject

General Materials Science

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