AI Medical Compendium Journal:
Frontiers in molecular biosciences

Showing 1 to 10 of 20 articles

Linking machine learning and biophysical structural features in drug discovery.

Frontiers in molecular biosciences
INTRODUCTION: Machine learning methods were applied to analyze pharmacophore features derived from four protein-binding sites, aiming to identify key features associated with ligand-specific protein conformations.

Anticarcinogenic cationic peptides derived from tryptic hydrolysis of β-lactoglobulin.

Frontiers in molecular biosciences
INTRODUCTION: This study investigated the tryptic hydrolysis of β-lactoglobulin (BLG) for 30, 60, 90, and 120 min at 1/200 E/S (enzyme/substrate ratio, w/w) to prepare potentially anticarcinogenic peptides.

Exploring the shared gene signatures and mechanism among three autoimmune diseases by bulk RNA sequencing integrated with single-cell RNA sequencing analysis.

Frontiers in molecular biosciences
BACKGROUND: Emerging evidence underscores the comorbidity mechanisms among autoimmune diseases (AIDs), with innovative technologies such as single-cell RNA sequencing (scRNA-seq) significantly advancing the explorations in this field. This study aime...

Biomarker discovery and development of prognostic prediction model using metabolomic panel in breast cancer patients: a hybrid methodology integrating machine learning and explainable artificial intelligence.

Frontiers in molecular biosciences
BACKGROUND: Breast cancer (BC) is a significant cause of morbidity and mortality in women. Although the important role of metabolism in the molecular pathogenesis of BC is known, there is still a need for robust metabolomic biomarkers and predictive ...

Application of machine learning for mass spectrometry-based multi-omics in thyroid diseases.

Frontiers in molecular biosciences
Thyroid diseases, including functional and neoplastic diseases, bring a huge burden to people's health. Therefore, a timely and accurate diagnosis is necessary. Mass spectrometry (MS) based multi-omics has become an effective strategy to reveal the c...

Identification of biomarkers and immune microenvironment associated with pterygium through bioinformatics and machine learning.

Frontiers in molecular biosciences
BACKGROUND: Pterygium is a complex ocular surface disease characterized by the abnormal proliferation and growth of conjunctival and fibrovascular tissues at the corneal-scleral margin. Understanding the underlying molecular mechanisms of pterygium i...

Integrated multi-omics analysis describes immune profiles in ischemic heart failure and identifies PTN as a novel biomarker.

Frontiers in molecular biosciences
INTRODUCTION: Heart failure is a leading global cause of mortality, with ischemic heart failure (IHF) being a major contributor. IHF is primarily driven by coronary artery disease, and its underlying mechanisms are not fully understood, particularly ...

Integrating clinical and cross-cohort metagenomic features: a stable and non-invasive colorectal cancer and adenoma diagnostic model.

Frontiers in molecular biosciences
Dysbiosis is associated with colorectal cancer (CRC) and adenomas (CRA). However, the robustness of diagnostic models based on microbial signatures in multiple cohorts remains unsatisfactory. In this study, we used machine learning models to screen...