Yearly Publication Trends - computational toxicology

Year	Publication Count
2024	29
2023	58
2022	71
2021	33
2020	23
2019	22
2018	10
2017	9
2016	12
2015	11
2014	12

Relevant Publications

Toward structure-multiple activity relationships (SMARts) using computational approaches: A polypharmacological perspective.

Issue Release: 2024

An automated computational data pipeline to rapidly acquire, score, and rank toxicological data for ecological hazard assessment.

Issue Release: 2024

The comprehensive prediction of carcinogenic potency and tumorigenic dose (TD) for two problematic N-nitrosamines in food: NMAMPA and NMAMBA using toxicology in silico methods.

Issue Release: 2024

Efficiency of pharmaceutical toxicity prediction in computational toxicology.

Issue Release: 2024

Machine Learning Models for Prediction of Xenobiotic Chemicals with High Propensity to Transfer into Human Milk.

Issue Release: 2024

Bio-QSARs 2.0: Unlocking a new level of predictive power for machine learning-based ecotoxicity predictions by exploiting chemical and biological information.

Issue Release: 2024

Mechanistic insight into biotransformation of novel triazine-based flame retardant 1,3,5-Tris(2,3-Dibromopropyl)-1,3,5-triazinane-2,4,6-trione by human cytochrome P450s.

Issue Release: 2024

The rat acute oral toxicity of trifluoromethyl compounds (TFMs): a computational toxicology study combining the 2D-QSTR, read-across and consensus modeling methods.

Issue Release: 2024

Deep Learning-based Modeling for Preclinical Drug Safety Assessment.

Issue Release: 2024

Physiologically-based pharmacokinetic model of in vitro porcine ear skin permeation for drug delivery research.

Issue Release: 2024

Identifying the toxic mechanisms of emerging electronic contaminations liquid crystal monomers and the construction of a priority control list for graded control.

Issue Release: 2024

Molecular modeling of the carbohydrate corona formation on a polyvinyl chloride nanoparticle and its impact on the adhesion to lipid bilayers.

Issue Release: 2024

In Silico Acute Aquatic Hazard Assessment and Prioritization Using a Grouped Target Site Model: A Case Study of Organic Substances Reported in Permian Basin Hydraulic Fracturing Operations.

Issue Release: 2024

Machine learning-based models to predict aquatic ecological risk for engineered nanoparticles: using hazard concentration for 5% of species as an endpoint.

Issue Release: 2024

Association of phthalate exposure with type 2 diabetes and the mediating effect of oxidative stress: A case-control and computational toxicology study.

Issue Release: 2024

Synergistic Activity of Noble Trimetallic Nanofluids: Unveiling Unprecedented Antimicrobial Potential and Computational Insights.

Issue Release: 2024

A Decade in a Systematic Review: The Evolution and Impact of Cell Painting.

Issue Release: 2024

Prediction of the Liver Safety Profile of a First-in-Class Myeloperoxidase Inhibitor Using Quantitative Systems Toxicology Modeling.

Issue Release: 2024

Preface to the Special Issue of Food and Chemical Toxicology on \"New approach methodologies and machine learning in food safety and chemical risk assessment: Development of reproducible, open-source, and user-friendly tools for exposure, toxicokinetic, and toxicity assessments in the 21st century\".

Issue Release: 2024

Oxidation Mechanism and Toxicity Evolution of Linalool, a Typical Indoor Volatile Chemical Product.

Issue Release: 2024