Results 121 to 130 of about 286,325 (326)

Accelerating Primary Screening of USP8 Inhibitors from Drug Repurposing Databases with Tree‐Based Machine Learning

open access: yesAdvanced Intelligent Discovery, EarlyView.
This study introduces a tree‐based machine learning approach to accelerate USP8 inhibitor discovery. The best‐performing model identified 100 high‐confidence repurposable compounds, half already approved or in clinical trials, and uncovered novel scaffolds not previously studied. These findings offer a solid foundation for rapid experimental follow‐up,
Yik Kwong Ng   +4 more
wiley   +1 more source

A Generalized Framework for Data‐Efficient and Extrapolative Materials Discovery for Gas Separation

open access: yesAdvanced Intelligent Discovery, EarlyView.
This study introduces an iterative supervised machine learning framework for metal‐organic framework (MOF) discovery. The approach identifies over 97% of the best performing candidates while using less than 10% of available data. It generalizes across diverse MOF databases and gas separation scenarios.
Varad Daoo, Jayant K. Singh
wiley   +1 more source

Predicting the Stability of Base‐mediated C─H Carboxylation Adducts Using Data Science Tools

open access: yesAngewandte Chemie, EarlyView.
A computational approach integrating quantum chemistry and machine learning enables the prediction of CO2–adduct stability. Model interpretability and experimental validation highlight its utility for designing base‐mediated C–H carboxylation reactions.
Maike Eckhoff   +6 more
wiley   +2 more sources

Eyelid retraction during smiling in a patient with monocular congenital ptosis: a case report

open access: yesBMC Ophthalmology
Background Blepharoptosis is a common symptom in ophthalmology clinic, but eyelid retraction when smiling in a ptosis eye is a rare manifestation. Here we report a novel manifestation that eyelid retraction during smiling in a patient with monocular ...
Yiyang Zhao, Jing Fu, Jie Hao
doaj   +1 more source

Intelligent Supportive System for People with Profound Intellectual and Multiple Disabilities

open access: yesAdvanced Intelligent Systems, EarlyView.
A holistic INSENSION system is developed—a novel intelligent decision support system leveraging state‐of‐the‐art noninvasive audio‐visual sensor technologies together with machine learning algorithms and expert knowledge, to detect and interpret behaviors and communications (nonverbal signals—NVSs) of people with PIMD in challenging real‐world ...
Gašper Slapničar   +10 more
wiley   +1 more source

Design and Experimental Validation of a Photocatalyst Recommender Based on a Large Language Model

open access: yesAngewandte Chemie, EarlyView.
Choosing a photocatalyst for a given reaction can be challenging due to complex mechanisms and multiple parameters that govern the outcome of a photocatalyzed reaction. Herein, we disclose a machine learning (ML) model that can suggest catalysts for a given reaction using an online portal.
Francis Millward   +13 more
wiley   +2 more sources

The influence of repeated frowning and smiling on corrugator muscle activity and wrinkles between eyebrows

open access: yesScientific Reports
Like the lines themselves, concerns about facial wrinkles, particularly glabellar lines - the prominent furrows between the eyebrows - intensify with age.
Shuntaro Okazaki   +2 more
doaj   +1 more source

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