Bioinformatics | Machine Learning | Pharmacology Gtie-Rt: A Comprehensive Graph Learning Model for Predicting Drugs Targeting Metabolic Pathways in Human. July 20, 2024
Biochemistry | Molecular Biology | Pharmacology Binding and sensing diverse small molecules using shape-complementary pseudocycles. July 18, 2024
Pharmacology | Surgery | Transcriptomics A versatile attention-based neural network for chemical perturbation analysis and its potential to aid surgical treatment: A experimental study. July 17, 2024
Neurology | Pharmacology In Silico drug repurposing pipeline using deep learning and structure based approaches in epilepsy. July 17, 2024
Bioinformatics | Computational Biology | Pharmacology GSRF-DTI: a framework for drug-target interaction prediction based on a drug-target pair network and representation learning on a large graph. July 17, 2024
Bioinformatics | Computational Biology | Pharmacology CPIExtract: A software package to collect and harmonize small molecule and protein interactions. July 15, 2024
Bioinformatics | Drug Discovery | Pharmacology Polypharmacology prediction: the long road toward comprehensively anticipating small-molecule selectivity to de-risk drug discovery. July 15, 2024
Metabolic Disorders | Pharmacology Discovering novel Cathepsin L inhibitors from natural products using artificial intelligence. July 15, 2024
Drug design | Machine Learning | Pharmacology AC-ModNet: Molecular Reverse Design Network Based on Attribute Classification. July 13, 2024
Cardiology | Pharmacology Salvianolic acid B inhibits thrombosis and directly blocks the thrombin catalytic site. July 12, 2024
Clinical Pharmacology | Model-Informed Drug Development | Neural Networks | Pharmacology Bridging pharmacology and neural networks: A deep dive into neural ordinary differential equations. July 12, 2024
Genetics | Pharmacology | Rheumatology Redefining a new frontier in alkaptonuria therapy with AI-driven drug candidate design via innovation. July 12, 2024