id	author	title	date	pages	extension	mime	words	sentences	flesch	summary	cache	txt
cord-018791-h3bfdr14	Rasulev, Bakhtiyor	Recent Developments in 3D QSAR and Molecular Docking Studies of Organic and Nanostructures	2016-12-09		.txt	text/plain	10404	526	45	In short, QSAR is a method to find correlations and mathematical models for congeneric series of compounds, affinities of ligands to their binding sites, rate constants, inhibition constants, toxicological effect, and many other biological activities, based on structural features, as well as group and molecular properties, such as electronic properties, polarizability, or steric properties (Klebe et al. Later authors improved this approach and by combining the two existing techniques, GRID and PLS, has developed a powerful 3D QSAR methodology, so-called comparative molecular field analysis (CoMFA) (Cramer et al. The main advantage of this combined approach of 3D QSAR and pharmacophore-based docking is to focus on specific key interaction for protein-ligand binding to improve drug candidates. Another group published in 2013 a study that conducted a comprehensive investigation of fullerene analogues by combined computational approach including quantum chemical, molecular docking, and 3D descriptors-based QSAR (Ahmed et al.	./cache/cord-018791-h3bfdr14.txt	./txt/cord-018791-h3bfdr14.txt