Large-Scale Meta-Analysis of Nanomaterials Toxicity Based on Natural Language Processing of Scientific Articles

Natural language processing (NLP) pipelines can mine the nanotoxicology literature at a scale and resolution that cannot be achieved by manual curation. Here, we established a NLP pipeline that coupled topic modeling and end point-specific extraction LLM prompts to convert ∼10<sup>6</sup> sentences extracted from abstracts of scientific articles into a structured knowledge base containing 13 nanotoxicology features. The pipeline is capable of analyzing and extracting nanomaterial descriptors such as size, ζ potential, and surface area, along with biological end points such as minimum inhibitory concentration (MIC), minimum bactericidal concentration (MBC) and lethal concentration 50% (LC<sub>50</sub>). Statistical convergence across multiple quantitative end points - MIC, MBC, microbial log reduction, and biofilm killing efficiency - shows that Ag-based nanomaterials are the most potent antimicrobial agents, showing lower MIC and MBC than ZnO, TiO<sub>2</sub> and Au analogs. This trend was also observed for individual pathogens such as <i>Escherichia coli</i> and <i>Staphylococcus aureus</i>. Most nanomaterials are within 1 to 100 nm, with nanoparticles featured in >80% of the studies. Although nanomaterials <50 nm often produce the lowest MIC and LC<sub>50</sub>, toxicity within a single size class spans orders of magnitude, underscoring the influence of surface chemistry, coatings, and colloidal behavior. In addition, adverse reproductive effects in <i>Caenorhabditis elegans</i> and <i>Daphnia magna</i>, and developmental abnormalities in <i>Danio rerio</i>, are predominantly related to Ag and TiO<sub>2</sub>. In general, our automated data extraction and the curation strategy transforms disparate literature into a machine-readable knowledge base that paves the way for data-driven predictions of nanomaterial hazards.

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Publication Details

Journal
ACS Applied Nano Materials
Published
2025-12-23
DOI
https://doi.org/10.1021/acsanm.5c05119
Primary Topic
Nanoparticles: synthesis and applications
Type
article
Field-Weighted Citation Impact
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article

Large-Scale Meta-Analysis of Nanomaterials Toxicity Based on Natural Language Processing of Scientific Articles

Andreia Filipa Pereira Faria, Romana Petry, Odair P. Ferreira, Andre Caetano et al.
ACS Applied Nano Materials
Nanoparticles: synthesis and applications
article

Large-Scale Meta-Analysis of Nanomaterials Toxicity Based on Natural Language Processing of Scientific Articles

Andreia Filipa Pereira Faria, Romana Petry, Odair P. Ferreira, Andre Caetano, Henry Kobs, José Sales, Diego S. T. Martinez, James M. Almeida, Amauri J. Paula
article en

Abstract

Natural language processing (NLP) pipelines can mine the nanotoxicology literature at a scale and resolution that cannot be achieved by manual curation. Here, we established a NLP pipeline that coupled topic modeling and end point-specific extraction LLM prompts to convert ∼10<sup>6</sup> sentences extracted from abstracts of scientific articles into a structured knowledge base containing 13 nanotoxicology features. The pipeline is capable of analyzing and extracting nanomaterial descriptors such as size, ζ potential, and surface area, along with biological end points such as minimum inhibitory concentration (MIC), minimum bactericidal concentration (MBC) and lethal concentration 50% (LC<sub>50</sub>). Statistical convergence across multiple quantitative end points - MIC, MBC, microbial log reduction, and biofilm killing efficiency - shows that Ag-based nanomaterials are the most potent antimicrobial agents, showing lower MIC and MBC than ZnO, TiO<sub>2</sub> and Au analogs. This trend was also observed for individual pathogens such as <i>Escherichia coli</i> and <i>Staphylococcus aureus</i>. Most nanomaterials are within 1 to 100 nm, with nanoparticles featured in >80% of the studies. Although nanomaterials <50 nm often produce the lowest MIC and LC<sub>50</sub>, toxicity within a single size class spans orders of magnitude, underscoring the influence of surface chemistry, coatings, and colloidal behavior. In addition, adverse reproductive effects in <i>Caenorhabditis elegans</i> and <i>Daphnia magna</i>, and developmental abnormalities in <i>Danio rerio</i>, are predominantly related to Ag and TiO<sub>2</sub>. In general, our automated data extraction and the curation strategy transforms disparate literature into a machine-readable knowledge base that paves the way for data-driven predictions of nanomaterial hazards.

ACS Applied Nano MaterialsVol. 9(1)
Instituto Tecnológico de Aeronáutica (BR), Universidade Estadual de Londrina (BR), Interface (United States) (US), Ministry of Infrastructure and Water Management (NL), University of Florida (US), Institute of Molecular Functional Materials (CN), Brazilian Center for Research in Energy and Materials (BR), Laboratório Nacional de Nanotecnologia
Quality Education
Openalex Percentile: Top 48%
Nanoparticles: synthesis and applications
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