Multicomponent Reaction for Synthesis, Molecular Docking and Anti-inflammatory Evaluation of Novel Indole-Thiazole Hybrid Derivatives
Synthesis of novel 4-substituted isatin Schiff base derivatives as potential autophagy inducers and evaluation of their antitumour activity
Metadynamics and Free-Energy Landscape Approaches for Structural Characterization of Galectin-3
Design, synthesis, and mechanism study of novel 1-arylisoquinoline derivatives as antifungal agents
Comparative Analysis of Gardenia. jasminoides Ellis and G. jasminoides var. Radicans Makino Based on Network Pharmacology
Exploring putative drug properties associated with TNF-alpha inhibition and identification of potential targets in cardiovascular disease using Machine Learning-Assisted QSAR Modeling and Virtual Reverse Pharmacology approach
(-)-Epicatechin metabolites as a GPER ligands: a theoretical perspective
Novel Quinolone substituted 1,3,4-oxadiazole derivatives: Design, synthesis, antimicrobial and anti-inflammatory potential
Interface-driven structural evolution on diltiazem as novel uPAR inhibitors: From in silico design to in vitro evaluation
Virtual Screening and Molecular Dynamics Simulation of Natural Compounds as Potential Inhibitors of Serine/Threonine Kinase 16 for Anticancer Drug Discovery