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Screening of multi deep learning-based de novo molecular generation models and their application for specific target molecular generation
Published 2025-02-01“…Abstract Traditional virtual screening methods need to explore expanse and vast chemical spaces and need to be based on existing chemical libraries. …”
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Identification of maize kernel varieties based on interpretable ensemble algorithms
Published 2025-02-01“…Morphological and hyperspectral data of maize samples were extracted and preprocessed, and three methods were used to screen features, respectively. The base learner of the Stacking integration model was selected using diversity and performance indices, with parameters optimized through a differential evolution algorithm incorporating multiple mutation strategies and dynamic adjustment of mutation factors and recombination rates. …”
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Development of prediction models for screening depression and anxiety using smartphone and wearable-based digital phenotyping: protocol for the Smartphone and Wearable Assessment f...
Published 2025-06-01“…The Smartphone and Wearable Assessment for Real-Time Screening of Depression and Anxiety study aims to develop prediction algorithms to identify individuals at risk for depressive and anxiety disorders, as well as those with mild-to-severe levels of either condition or both. …”
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Screening for endometriosis: A scoping review of screening measures that could support early diagnosis
Published 2025-07-01“…Despite reporting symptoms, women wait around 11 years before receiving a diagnosis, further interfering with their mental and physical health. Patient reported screening measures can promote faster diagnosis, however their measurement quality remains unknown. …”
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Development and Internal Validation of a Machine Learning-Based Colorectal Cancer Risk Prediction Model
Published 2025-03-01“…<b>Methods:</b> We analyzed data from 154,887 adults, aged 55–74 years, who participated in the Prostate, Lung, Colorectal, and Ovarian (PLCO) Cancer Screening Trial. A risk prediction model was built using the Light Gradient Boosting Machine (LightGBM) algorithm. …”
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The Bridge between Screening and Assessment: Establishment and Application of Online Screening Platform for Food Risk Substances
Published 2021-01-01“…The screening comparison algorithm, the core of the screening model, is obtained through the improvement of the existing spectral library search algorithm. …”
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88
DKK3 and SERPINB5 as novel serum biomarkers for gastric cancer: facilitating the development of risk prediction models for gastric cancer
Published 2025-03-01“…The existing gastric cancer (GC) risk prediction models based on biomarkers are limited. This study aims to identify new promising biomarkers for GC to develop a risk prediction model for effective assessment, screening, and early diagnosis. …”
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A recurrent neural network and parallel hidden Markov model algorithm to segment and detect heart murmurs in phonocardiograms.
Published 2024-11-01“…These properties make the algorithm a promising tool for screening of abnormal heart murmurs.…”
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Revolutionizing pharmacology: AI-powered approaches in molecular modeling and ADMET prediction
Published 2025-12-01“…It outlines the evolution of computational chemistry and the transformative role of AI in interpreting complex molecular data, automating feature extraction, and improving decision-making across the drug development pipeline. Core AI algorithms support vector machines, random forests, graph neural networks, and transformers are examined for their applications in molecular representation, virtual screening, and ADMET property prediction. …”
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RETRACTED ARTICLE: Screening and identification of susceptibility genes for cervical cancer via bioinformatics analysis and the construction of an mitophagy-related genes diagnosti...
Published 2024-09-01“…Abstract Purpose This study aims to utilize bioinformatics methods to systematically screen and identify susceptibility genes for cervical cancer, as well as to construct and validate an mitophagy-related genes (MRGs) diagnostic model. …”
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92
Prediction of Coiled Tubing Erosion Rate Based on Sparrow Search Algorithm Back-Propagation Neural Network Model
Published 2024-10-01“…To accurately predict the erosion rate of coiled tubing, this study studied the influence law of erosion rate through experiments, screened the main influencing factors of erosion rate by grey relational analysis (GRA), and established a back-propagation neural network (BPNN) model optimized by the sparrow search algorithm (SSA) to predict the erosion rate. …”
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Machine learning algorithms in constructing prediction models for assisted reproductive technology (ART) related live birth outcomes
Published 2024-12-01“…Multiple candidate predictors were screened out by using the importance scores. Four machine learning (ML) algorithms including random forest, extreme gradient boosting, light gradient boosting machine and binary logistic regression were used to construct prediction models. …”
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Semiparametric Transformation Models with a Change Point for Interval-Censored Failure Time Data
Published 2025-08-01“…Model parameters are estimated via the EM algorithm, with the change point identified through a profile likelihood approach using grid search. …”
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Comparing the performance of screening surveys versus predictive models in identifying patients in need of health-related social need services in the emergency department.
Published 2024-01-01“…We built an XGBoost classification algorithm using responses from the screening questionnaire to predict HRSN needs (screening questionnaire model). …”
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Cell‐free epigenomes enhanced fragmentomics‐based model for early detection of lung cancer
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Machine learning-driven development of a stratified CES-D screening system: optimizing depression assessment through adaptive item selection
Published 2025-03-01“…We employed a two-stage machine learning approach: first applying Recursive Feature Elimination with multiple linear regression to identify core predictive items for total depression scores, followed by logistic regression for optimizing depression classification (CES-D ≥ 16). Model performance was systematically evaluated through discrimination (ROC analysis), calibration (Brier score), and clinical utility analyses (decision curve analysis), with additional validation using random forest and support vector machine algorithms across independent samples. …”
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Construction of risk prediction model of sentinel lymph node metastasis in breast cancer patients based on machine learning algorithm
Published 2025-05-01“…Subsequently, five ML algorithms, namely LOGIT, LASSO, XGBOOST, RANDOM FOREST model and GBM model were employed to train and develop an ML model. …”
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