Orexin 2 receptor Crosstalk with GLP1 receptor reveals dual therapy for improvement of Sleep deprivation-induced obesity: An Integrated Network Pharmacology, Molecular Docking and Molecular Dynamics Simulation approach
Synthesis and anti-liver fibrotic activity study of a chalcone derivative through anti-inflammatory effects and inhibition of JNK/NF-κB signaling pathways
Design, Synthesis, Biological Activity and In Silico Evaluation of Novel Phenylthiazole Derivatives as Multifunctional Skin-Whitening Agents
In Silico Discovery of Natural and Synthetic Inhibitors Targeting AKT1 in Prostate Cancer
Morin Modulates Key Targets and Pathways Associated with Gastric Cancer: Network Pharmacology, Molecular Docking, Molecular Dynamics, ADMET, and In‑Vitro Analysis
Metal-Free Carbenoid C–H Insertion: A Versatile Strategy for Constructing Fluorenes with Quaternary Carbon Centers
Molecular Design and Virtual Screening of EZH2 Inhibitors Based on GRU Networks
Deep Learning-Enhanced QSAR Modeling for Predicting Developmental Neurotoxicity Based on Molecular Initiating Events from Adverse Outcome Pathways
Novel Carbazole-Triazole-Thioether Conjugates as Multifunctional Antimicrobial Agents against Phytopathogen
TMolNet: A Task-Aware Multimodal Neural Network for Molecular Property Prediction