Computer Science | Drug Discovery | Pharmacology Artificial Intelligence in ADME Property Prediction. September 7, 2023
Artificial Intelligence | Cardiology | Drug Discovery Use of Deep-Learning Assisted Assessment of Cardiac Parameters in Zebrafish to Discover Cyanidin Chloride as a Novel Keap1 Inhibitor Against Doxorubicin-Induced Cardiotoxicity. September 7, 2023
Artificial Intelligence | Drug Discovery | Oncology Role of Artificial Intelligence in Drug Discovery and Target Identification in Cancer. September 6, 2023
Bioinformatics | Drug Discovery | Pharmacology A Deep Learning Approach to the Prediction of Drug Side-Effects on Molecular Graphs. September 1, 2023
Chemistry | Drug Discovery DFRscore: Deep Learning-Based Scoring of Synthetic Complexity with Drug-Focused Retrosynthetic Analysis for High-Throughput Virtual Screening. August 31, 2023
Drug Discovery | Machine Learning | Pharmacology Multiobjective Molecular Optimization for Opioid Use Disorder Treatment Using Generative Network Complex. August 25, 2023
Artificial Intelligence | Drug Discovery | Pharmacology Enhancing Opioid Bioactivity Predictions through Integration of Ligand-Based and Structure-Based Drug Discovery Strategies with Transfer and Deep Learning Techniques. August 23, 2023
Drug Discovery | Protein structure prediction zPoseScore model for accurate and robust protein-ligand docking pose scoring in CASP15. August 22, 2023
Artificial Intelligence | Chemistry | Drug Discovery Self-supervised learning with chemistry-aware fragmentation for effective molecular property prediction. August 20, 2023
Chemistry | Drug Discovery HimGNN: a novel hierarchical molecular graph representation learning framework for property prediction. August 18, 2023
Bioinformatics | Drug Discovery | Pharmaceutical Sciences Generating Potential Protein-Protein Interaction Inhibitor Molecules Based on Physicochemical Properties. August 12, 2023
Bioinformatics | Drug Discovery | Pharmacology FSM-DDTR: End-to-end feedback strategy for multi-objective De Novo drug design using transformers. August 9, 2023