Biochemistry | Chemoinformatics | Pharmacology First report on chemometrics-driven multilayered lead prioritization in addressing oxysterol-mediated overexpression of G protein-coupled receptor 183. March 9, 2024
Bioinformatics | Drug Development | Pharmacology A consensual machine-learning-assisted QSAR model for effective bioactivity prediction of xanthine oxidase inhibitors using molecular fingerprints. April 12, 2023
Infectious Diseases | Pharmacology Virtual screening and molecular dynamics simulations provide insight into repurposing drugs against SARS-CoV-2 variants Spike protein/ACE2 interface. January 27, 2023
Environmental Health | Public Health | Toxicology A real time QSAR-driven toxicity evaluation and monitoring of iron containing fine particulate matters in indoor subway stations. February 15, 2019