Bioinformatics | Pharmacology | Systems Biology Graph embedding on mass spectrometry- and sequencing-based biomedical data. January 3, 2024
Biochemistry | Pharmacology Using deep learning and molecular dynamics simulations to unravel the regulation mechanism of peptides as noncompetitive inhibitor of xanthine oxidase. January 3, 2024
Artificial Intelligence | Drug design | Pharmacology Is fragment-based graph a better graph-based molecular representation for drug design? A comparison study of graph-based models. January 3, 2024
Bioinformatics | Computational Chemistry | Drug Discovery | Pharmacology A deep learning framework for predicting molecular property based on multi-type features fusion. December 31, 2023
Biochemistry | Neurology | Pharmacology Investigation of the Binding Interaction of Mfsd2a with NEDD4-2 via Molecular Dynamics Simulations. December 29, 2023
Critical Care Medicine | Machine Learning | Pharmacology A Deep Learning-Based Approach for Prediction of Vancomycin Treatment Drug Monitoring: Retrospective Data of Critically Ill Patients. December 28, 2023
Neurology | Oncology | Pharmacology Cation Chloride Cotransporter NKCC1 Operates through a Rocking-Bundle Mechanism. December 26, 2023
Molecular Biology | Oncology | Pharmacology Discovery of potential WEE1 inhibitors via hybrid virtual screening. December 25, 2023
Bioinformatics | Pharmacology TEFDTA: A Transformer Encoder and Fingerprint Representation Combined Prediction Method for Bonded and Non-Bonded Drug-Target Affinities. December 23, 2023
Bioinformatics | Pharmacology Fusing Sequence and Structural Knowledge by Heterogeneous Models to Accurately and Interpretively Predict Drug-Target Affinity. December 23, 2023
Computational Biology | Pharmacology | Virology How Deep Learning in Antiviral Molecular Profiling Identified Anti-SARS-CoV-2 Inhibitors. December 23, 2023
Bioinformatics | Computer Science | Pharmacology Comprehensive Review of Drug-Drug Interaction Prediction Based on Machine Learning: Current Status, Challenges, and Opportunities. December 22, 2023