Oncology | Pharmacology An attention mechanism-based LSTM network for cancer kinase activity prediction. September 5, 2022
Drug Discovery | Pharmacology In Silico Prediction of Human and Rat Liver Microsomal Stability via Machine Learning Methods. September 2, 2022
Bioinformatics | Pharmacology | Virology A geometric deep learning model for display and prediction of potential drug-virus interactions against SARS-CoV-2. August 31, 2022
Personalized Medicine | Pharmacology Reinforcement learning for systems pharmacology-oriented and personalized drug design. August 30, 2022
Diabetology | Pharmacology | Traditional Medicine Bipartite graph search optimization for type II diabetes mellitus Jamu formulation using branch and bound algorithm. August 29, 2022
Drug Discovery | Medicinal Chemistry | Pharmacology A scaffold-based deep generative model considering molecular stereochemical information. August 28, 2022
Genetics | Personalized Medicine | Pharmacology Next-Generation Personalized Medicine: Implementation of Variability Patterns for Overcoming Drug Resistance in Chronic Diseases. August 26, 2022
Chemoinformatics | Oncology | Pharmacology Evaluating molecular representations in machine learning models for drug response prediction and interpretability. August 26, 2022
Drug Development | Pharmacology Identifying the kind behind SMILES-anatomical therapeutic chemical classification using structure-only representations. August 26, 2022
Drug Development | Neurology | Pharmacology A merged molecular representation deep learning method for blood-brain barrier permeability prediction. August 25, 2022
Chemistry | Drug Discovery | Pharmacology ComABAN: refining molecular representation with the graph attention mechanism to accelerate drug discovery. August 23, 2022
Bioinformatics | Drug Discovery | Pharmacology Profiling prediction of nuclear receptor modulators with multi-task deep learning methods: toward the virtual screening. August 23, 2022