AI Medical Compendium

Ionic liquids as emerging environmental contaminants: a critical review of fate, toxicity mechanisms, and sustainable design strategies.

SAR and QSAR in environmental research May 18, 2026

Ionic liquids (ILs) are increasingly detected in various environments, raising profound concerns regarding their ecological impacts and long-term sustainability. While their tunability offers immense application potential, it concurrently introduces ... read more

An Integrated Data-Mining Strategy via Transcriptomics and DIA Quantitative Proteomics to Unveil Chemical Attribution Signature Peptides for Tracing Origins of Castor Beans.

Analytical chemistry May 18, 2026

The increasing frequency of castor bean or ricin-induced intoxication or terror events threatens public safety and national security, making the tracing of castor bean origins critical for law enforcement and counterterrorism efforts. Chemical attrib... read more

Radiation biomarker screening and dose reconstruction based on machine learning.

International journal of radiation biology May 18, 2026

PURPOSE: Nuclear emergency medical rescue is a critical component of the nuclear emergency response system, playing a vital role in safeguarding public life and health. To address the urgent need for rapid, wide-range radiation biodosimetry in nuclea... read more

CSCAN: Conformational Analysis of Macrocyclic Peptides through NMR Chemical Shifts.

Journal of chemical information and modeling May 18, 2026

Macrocyclic peptides are increasingly used to bridge the gap between small molecules and biologics. Their biological activity and pharmacological properties are governed by conformation, making a detailed understanding of the conformational landscape... read more

Targeting bacterial metal dependence: material design with computational frontiers.

Biomaterials science May 18, 2026

Antimicrobial resistance (AMR) constitutes a profound global health crisis, necessitating the development of unconventional therapeutic targets. Bacterial reliance on transition metals for metabolism, virulence, and survival creates a conserved, unde... read more

Research progress and interfacial adhesion mechanisms of oral delivery systems based on natural polymers.

Journal of materials chemistry. B May 18, 2026

Oral mucoadhesive delivery is a significant strategy for drug administration due to its capacity to bypass hepatic first-pass metabolism and enhance drug bioavailability. However, the highly moist environment and frequent mechanical stresses in the m... read more

Machine learning accelerated nitrogen electrofixation on dual-atom catalysts.

Nanoscale May 18, 2026

Atomically dispersed catalysts offer the merits of theoretically maximum atomic utilization and adjustable electronic properties. While the current research focuses on single-atom catalysts, new opportunities would be opened by constructing dual-atom... read more

Direct Ab Initio Simulation of the Synthesis of BaZrO3 and the Microstructure Impacts on Proton Transport.

ACS nano May 18, 2026

Controlling and predicting the processing-structure-performance relationship in functional materials is a grand challenge in materials science, with important implications for a wide range of emerging applications; a high fidelity understanding of th... read more

Comparing Facial Attractiveness and Professional Acceptance Between Real and AI-Generated Orthodontic Treatment Outcome Images.

Orthodontics & craniofacial research May 18, 2026

BACKGROUND: Facial attractiveness influences social and professional perceptions, including competence and employability. With the increasing use of artificial intelligence (AI) to generate photorealistic faces, it is important to understand how thes... read more

Machine Learning-Based Model for Predicting Short- and Long-Term Growth in Untreated Class III Malocclusion.