Oncology | Pharmacology Explainable deep learning for tumor dynamic modeling and overall survival prediction using Neural-ODE. November 18, 2023
Bioinformatics | Drug Discovery | Pharmacology AttentionMGT-DTA: A multi-modal drug-target affinity prediction using graph transformer and attention mechanism. November 17, 2023
Chemistry | Pharmacology Variational autoencoder-based chemical latent space for large molecular structures with 3D complexity. November 17, 2023
Chemistry | Drug design | Pharmacology A flexible data-free framework for structure-based drug design with reinforcement learning. November 16, 2023
Bioinformatics | Pharmacology | Protein Design A new age in protein design empowered by deep learning. November 16, 2023
Bioengineering | Immunology | Pharmacology DG-Affinity: predicting antigen-antibody affinity with language models from sequences. November 14, 2023
Biochemistry | Drug Discovery | Pharmacology Determination of Novel SARS-CoV-2 Inhibitors by Combination of Machine Learning and Molecular Modeling Methods. November 14, 2023
Artificial Intelligence | Drug Development | Machine Learning | Pharmacology Deep Learning for Drug Development: Using CNNs in MIA-QSAR to Predict Plasma Protein Binding of Drugs. November 14, 2023
Diabetology | Pharmacology | Traditional Chinese Medicine Integration of Deep Learning and Sequential Metabolism to Rapidly Screen Dipeptidyl Peptidase (DPP)-IV Inhibitors from . November 14, 2023
Anesthesiology | Deep Learning | Pharmacology A Deep Learning Framework for Anesthesia Depth Prediction from Drug Infusion History. November 14, 2023
COVID-19 Therapy | Drug Repurposing | Pharmacology Attention Mechanism-Based Graph Neural Network Model for Effective Activity Prediction of SARS-CoV-2 Main Protease Inhibitors: Application to Drug Repurposing as Potential COVID-19 Therapy. November 14, 2023
Pharmacology A general hypergraph learning algorithm for drug multi-task predictions in micro-to-macro biomedical networks. November 13, 2023