In silico toxicology: computational methods for the prediction of chemical toxicity

AB Raies, VB Bajic - Wiley Interdisciplinary Reviews …, 2016 - Wiley Online Library
Determining the toxicity of chemicals is necessary to identify their harmful effects on humans,
animals, plants, or the environment. It is also one of the main steps in drug design. Animal …

Converting nanotoxicity data to information using artificial intelligence and simulation

X Yan, T Yue, DA Winkler, Y Yin, H Zhu… - Chemical …, 2023 - ACS Publications
Decades of nanotoxicology research have generated extensive and diverse data sets.
However, data is not equal to information. The question is how to extract critical information …

Representing and describing nanomaterials in predictive nanoinformatics

E Wyrzykowska, A Mikolajczyk, I Lynch… - Nature …, 2022 - nature.com
Engineered nanomaterials (ENMs) enable new and enhanced products and devices in
which matter can be controlled at a near-atomic scale (in the range of 1 to 100 nm) …

Role of artificial intelligence and machine learning in nanosafety

DA Winkler - Small, 2020 - Wiley Online Library
Robotics and automation provide potentially paradigm shifting improvements in the way
materials are synthesized and characterized, generating large, complex data sets that are …

[HTML][HTML] NanoSolveIT Project: Driving nanoinformatics research to develop innovative and integrated tools for in silico nanosafety assessment

A Afantitis, G Melagraki, P Isigonis, A Tsoumanis… - Computational and …, 2020 - Elsevier
Nanotechnology has enabled the discovery of a multitude of novel materials exhibiting
unique physicochemical (PChem) properties compared to their bulk analogues. These …

Understanding nanoparticle toxicity to direct a safe-by-design approach in cancer nanomedicine

JA Damasco, S Ravi, JD Perez, DE Hagaman… - Nanomaterials, 2020 - mdpi.com
Nanomedicine is a rapidly growing field that uses nanomaterials for the diagnosis, treatment
and prevention of various diseases, including cancer. Various biocompatible nanoplatforms …

An ancestral molecular response to nanomaterial particulates

G Del Giudice, A Serra, LA Saarimäki, K Kotsis… - Nature …, 2023 - nature.com
The varied transcriptomic response to nanoparticles has hampered the understanding of the
mechanism of action. Here, by performing a meta-analysis of a large collection of …

Evaluating metal oxide nanoparticle (MeOx NP) toxicity with different types of nano descriptors mainly focusing on simple periodic table-based descriptors: a mini …

J Roy, K Roy - Environmental Science: Nano, 2023 - pubs.rsc.org
Given the rapid growth of nanotechnology, it is essential to know the hazardous effects of
metal oxide nanoparticles (MeOx NPs) posed to the living organisms within the ecosystem …

Practices and trends of machine learning application in nanotoxicology

I Furxhi, F Murphy, M Mullins, A Arvanitis, CA Poland - Nanomaterials, 2020 - mdpi.com
Machine Learning (ML) techniques have been applied in the field of nanotoxicology with
very encouraging results. Adverse effects of nanoforms are affected by multiple features …

Toxicity of engineered metal oxide nanomaterials mediated by nano–bio–eco–interactions: a review and perspective

X He, WG Aker, PP Fu, HM Hwang - Environmental Science: Nano, 2015 - pubs.rsc.org
Along with the expanding use of engineered metal oxide nanomaterials (MONMs), there is a
growing concern over their unintentional adverse toxicological effects on human health and …