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The accurate prediction of protein structures remains a cornerstone challenge in structural bioinformatics, essential for understanding the intricate relationship between protein sequence, structure, and function. Recent advancements in Machine Learning (ML) and Deep Learning (DL) have revolutionized this field, offering innovative approaches to tackle one- dimensional (1D) protein structure annotations, including secondary structure, solvent accessibility, and intrinsic disorder. This review highlights the evolution of predictive methodologies, from early machine learning models to sophisticated deep learning frameworks that integrate sequence embeddings and pretrained language models. Key advancements, such as AlphaFold's transformative impact on structure prediction and the rise of protein language models (PLMs), have enabled unprecedented accuracy in capturing sequence-structure relationships. Furthermore, we explore the role of specialized datasets, benchmarking competitions, and multimodal integration in shaping state-of-the-art prediction models. By addressing challenges in data quality, scalability, interpretability, and task-specific optimization, this review underscores the transformative impact of ML, DL, and PLMs on 1D protein prediction while providing insights into emerging trends and future directions in this rapidly evolving field.
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http://dx.doi.org/10.1016/j.csbj.2025.04.005 | DOI Listing |
JMIR Res Protoc
September 2025
Department of Urology, Faculty of Medicine, Universitas Indonesia - Cipto Mangunkusumo Hospital, Jakarta, Indonesia.
Background: Circumcision is a widely practiced procedure with cultural and medical significance. However, certain penile abnormalities-such as hypospadias or webbed penis-may contraindicate the procedure and require specialized care. In low-resource settings, limited access to pediatric urologists often leads to missed or delayed diagnoses.
View Article and Find Full Text PDFJ Chem Inf Model
September 2025
Department of Chemistry, Delaware State University, Dover, Delaware 19901, United States.
The calculation of the highest occupied molecular orbital-lowest unoccupied molecular orbital (HOMO-LUMO) gap for chemical molecules is computationally intensive using quantum mechanics (QM) methods, while experimental determination is often costly and time-consuming. Machine Learning (ML) offers a cost-effective and rapid alternative, enabling efficient predictions of HOMO-LUMO gap values across large data sets without the need for extensive QM computations or experiments. ML models facilitate the screening of diverse molecules, providing valuable insights into complex chemical spaces and integrating seamlessly into high-throughput workflows to prioritize candidates for experimental validation.
View Article and Find Full Text PDFJ Cataract Refract Surg
July 2025
Department of Ophthalmology, West China Hospital of Sichuan University, Chengdu City, Sichuan Province, China.
Purpose: To develop and validate a multimodal deep-learning model for predicting postoperative vault height and selecting implantable collamer lens (ICL) sizes using Anterior Segment Optical Coherence Tomography (AS-OCT) and Ultrasound Biomicroscope (UBM) images combined with clinical features.
Setting: West China Hospital of Sichuan University, China.
Design: Deep-learning study.
JMIR Med Inform
September 2025
College of Medical Informatics, Chongqing Medical University, 1 Yixueyuan Road, Yuzhong District, Chongqing, 400016, China, 86 13500303273.
Background: Cirrhosis is a leading cause of noncancer deaths in gastrointestinal diseases, resulting in high hospitalization and readmission rates. Early identification of high-risk patients is vital for proactive interventions and improving health care outcomes. However, the quality and integrity of real-world electronic health records (EHRs) limit their utility in developing risk assessment tools.
View Article and Find Full Text PDFJMIR AI
September 2025
Faculty of Medicine, Universidade Federal de Alagoas, Av. Lourival Melo Mota, S/n - Tabuleiro do Martins, Maceió, 57072-900, Brazil, 558232141461.
Background: Artificial intelligence (AI) has the potential to transform global health care, with extensive application in Brazil, particularly for diagnosis and screening.
Objective: This study aimed to conduct a systematic review to understand AI applications in Brazilian health care, especially focusing on the resource-constrained environments.
Methods: A systematic review was performed.