Insights into structural, vibrational, and chemical shift characteristics, solvents impact (polar and nonpolar) on electronic properties and reactive sites, ADMET predictions, and ligand-protein interactions for antiviral drugs safrole and isosafrole: An in-silico approach

Autor: Kumar, A. Ram, Selvaraj, S., Rajkumar, P., Dhanalakshmi, J., Kumar, Mohanraj, Nagarajan, Senthil Kumar, Jayaprakash, P., Mol, G.P. Sheeja, Awasthi, Shikha, Pandey, Sarvesh Kumar
Zdroj: In Chemical Physics Impact June 2024 8
Databáze: ScienceDirect