Biochemistry | Pharmacology BioDKG-DDI: predicting drug-drug interactions based on drug knowledge graph fusing biochemical information. April 3, 2022
Bioinformatics | Pharmacology Pocket2Drug: An Encoder-Decoder Deep Neural Network for the Target-Based Drug Design. April 1, 2022
Oncology | Pharmacology | Precision Medicine DeepTTA: a transformer-based model for predicting cancer drug response. March 29, 2022
Chemistry | Pharmacology Stereoselective synthesis of tri-substituted tetrahydrothiophenes and their binding against mycobacterial protein tyrosine phosphatase B. March 28, 2022
Drug Discovery | Pharmacology A Novel Deep Neural Network Technique for Drug-Target Interaction. March 26, 2022
Pharmacology | Protein Engineering Rethinking Protein Drug Design with Highly Accurate Structure Prediction of Anti-CRISPR Proteins. March 26, 2022
Neuroscience | Pharmacology | Psychiatry Discovery of Novel Trace Amine-Associated Receptor 5 (TAAR5) Antagonists Using a Deep Convolutional Neural Network. March 25, 2022
Dermatology | Pharmacology Caffeoyl malic acid is a potential dual inhibitor targeting TNFα/IL-4 evaluated by a combination strategy of network analysis-deep learning-molecular simulation. March 24, 2022
Bioinformatics | Drug Discovery | Pharmacology ELECTRA-DTA: a new compound-protein binding affinity prediction model based on the contextualized sequence encoding. March 16, 2022
Neurology | Pharmacology | Psychiatry Machine Learning Analysis of Cocaine Addiction Informed by DAT, SERT, and NET-Based Interactome Networks. March 16, 2022
Medicinal Chemistry | Pharmacology DeLA-Drug: A Deep Learning Algorithm for Automated Design of Druglike Analogues. March 16, 2022
Biochemistry | Chemistry | Pharmacology Prediction of Maximum Absorption Wavelength Using Deep Neural Networks. March 15, 2022