AI Medical Compendium

Deciphering Short-Range Order in 2D Transition Metal Dichalcogenides: From Origin to Multi-Scale Property Modulation.

Advanced science (Weinheim, Baden-Wurttemberg, Germany) Apr 17, 2026

Chemical short-range order (SRO) is a critical structural characteristic in multi-principal element materials, governing the global electronic properties including band gap. Yet its effect on site-resolved properties, such as magnetic moments and d-b... read more

Local environment neighbor sensitivity analysis: visualization of cation effect at liquid-solid interface.

Chemical communications (Cambridge, England) Apr 17, 2026

We present a method to extract the effects of environmental neighbors on local energies in heterogeneous systems from machine-learning force fields and demonstrate its ability to visualize cation-induced stabilization of hydroxyl groups on Pt in wate... read more

Accelerating Density Fitting with Adaptive Precision and 8-Bit Integer on AI Accelerators.

The journal of physical chemistry. A Apr 17, 2026

The emergence of artificial intelligence (AI) accelerators like NVIDIA Tensor Cores offers new opportunities to speed up tensor-heavy scientific computations. However, applying them to quantum chemistry is challenging due to strict accuracy demands a... read more

Machine learning-based closed-loop for optimizing HOMO-LUMO gap in diarylethene.

Physical chemistry chemical physics : PCCP Apr 17, 2026

Diarylethenes are a class of photochromic molecular switches whose performance in photoresponsive applications critically depends on the optimization and fine-tuning of the HOMO-LUMO gap. The ability to modulate this gap through rational structural m... read more

Exploring the potential targets and mechanisms of malachite green induced lung adenocarcinoma through network toxicology and molecular docking.

Medicine Apr 17, 2026

Malachite green (MG), a synthetic dye, has turned into a major risk to human health, because of its toxicity of teratogenic, genotoxic, carcinogenic, and immunosuppressive properties. And the result of ADMETLAB 2.0 platform prediction shows that MG i... read more

Transformation of Parkinson's care through SMART-PD (Self-Management, Remote monitoring and Timely review for Parkinson's Disease): Care pathway mapping with clinical experts.

Journal of Parkinson's disease Apr 17, 2026

Purpose of researchSMaRT-PD is a clinical decision support system (CDSS) for the home-based management and care of Parkinson's disease. It utilises remote monitoring and artificial intelligence to generate patient and clinician-facing outputs with se... read more

Digital experts for fibromyalgia: A comparative analysis of ChatGPT, Gemini, and DeepSeek in addressing patient questions with focus on readability and medical accuracy.

Work (Reading, Mass.) Apr 17, 2026

BackgroundPatients with fibromyalgia require clear and reliable medical information to manage a complex chronic condition. AI-based tools may offer valuable support for patient education.ObjectiveTo evaluate and compare the performance of three AI mo... read more

Rational and Multidimensional Optimization of Nanozyme Catalytic Performance.

Small (Weinheim an der Bergstrasse, Germany) Apr 17, 2026

Nanozymes are a class of nanomaterials with intrinsic biocatalytic activities. Compared to natural enzymes, they offer superior stability, precise structural tunability, and significant cost-effectiveness. Beyond serving as robust alternatives, nanoz... read more

Independent bone-level diagnostic accuracy study of an AI tool for detecting appendicular skeletal fractures on radiographs.

European radiology Apr 17, 2026

OBJECTIVES: To perform an in-depth evaluation of the diagnostic test accuracy of a commercially available AI tool for assistance in fracture detection on radiographs. MATERIALS AND METHODS: This retrospective study included consecutive patients with ... read more

Artificial intelligence assisted behavioral profiling of synthetic cannabinoids in planarians.

Forensic toxicology Apr 17, 2026

Artificial Intelligence Medical Compendium