Drug Discovery | Pharmacology Artificial Intelligence-Enabled De Novo Design of Novel Compounds that Are Synthesizable. November 3, 2021
Drug Safety | Metabolism | Pharmacology Artificial Intelligence in Drug Safety and Metabolism. November 3, 2021
Bioinformatics | Pharmacology ScaffComb: A Phenotype-Based Framework for Drug Combination Virtual Screening in Large-Scale Chemical Datasets. November 1, 2021
Health Informatics | Pharmacology A similarity-based deep learning approach for determining the frequencies of drug side effects. October 31, 2021
Bioinformatics | Pharmacology Deep learning in target prediction and drug repositioning: recent advances and challenges. October 31, 2021
Bioinformatics | Computational Biology | Pharmacology Using computers to ESKAPE the antibiotic resistance crisis. October 24, 2021
Hepatology | Nephrology | Pharmacology Molecular Properties of Drugs Handled by Kidney OATs and Liver OATPs Revealed by Chemoinformatics and Machine Learning: Implications for Kidney and Liver Disease. October 23, 2021
Data Science | Oncology | Pharmacology Prediction of synergistic drug combinations using PCA-initialized deep learning. October 21, 2021
Bioinformatics | Computational Biology | Pharmacology Deep-AFPpred: identifying novel antifungal peptides using pretrained embeddings from seq2vec with 1DCNN-BiLSTM. October 20, 2021
Bioinformatics | Computational Biology | Pharmacology HyperAttentionDTI: improving drug-protein interaction prediction by sequence-based deep learning with attention mechanism. October 19, 2021
Bioinformatics | Pharmacology Drug-target interaction predication via multi-channel graph neural networks. October 18, 2021
Computational Biology | Pharmacology | Toxicology Multitask CapsNet: An Imbalanced Data Deep Learning Method for Predicting Toxicants. October 18, 2021