id	author	title	date	pages	extension	mime	words	sentences	flesch	summary	cache	txt
cord-318524-704w8ldm	Kadir, M.A.	Experimental and DFT data of p-chlorocalix[4]arene as drugs receptor	2020-09-02		.txt	text/plain	1356	83	55	The data in this article provide information on spectroscopic and theoretical data for p-chlorocalix[4]arene when combined with selected drugs, such as paracetamol, ibuprofen, and cetirizine. It is interesting to note that of the three titled drugs identified, p-chlorocalix[4]arene showed the highest interaction energy with paracetamol, followed by ibuprofen and cetirizine. Keywords p-Chlorocalix [4] arene, paracetamol, interaction energy, molecular receptors, Gaussian Specifications Table Subject Chemistry Gaussian 09 software was used to calculate the interactions between host (pchlorocalix [4] arene ) and guest molecules (paracetamol, ibuprofen, and cetirizine) The p-chlorocalix [4] arene acted as molecular host, and three selected guest drugs namely paracetamol, ibuprofen, and cetirizine, acted as the guest molecules. The diagram showed that pchlorocalix [4] arene and cetirizine has the lowest energy band gap (2.9321 eV) as compared to paracetamol (4.9239 eV) and ibuprofen (5.1128 eV).	./cache/cord-318524-704w8ldm.txt	./txt/cord-318524-704w8ldm.txt