{"product_id":"molecular-modeling-of-inclusion-complexes-von-boubaker-hosouna-rohana-adnan","title":"Molecular Modeling of Inclusion complexes","description":"\u003cp\u003eHerein the study of inclusion complex of methyl red and cyclodextrins (¿, ¿ and ¿-CDs), were investigated using molecular modeling calculation and UV-Vis spectroscopy. The molecular modeling study adopted was docking using Autodock 4.2 software and quantum mechanics calculation using Gaussian 03 software. The UV-Vis spectroscopy results were found to be comparable with the quantum mechanics calculations performed using the semiempirical method PM3. The experimental data (UV, pH, Kb) show that ¿-CD is the best host among the studied CD compounds in the following order: MR-¿-CD » MR-¿-CD » MR-¿-CD. Keywords: inclusion complex, ¿, ¿ and ¿-cyclodextrins, methyl red.\u003c\/p\u003e\u003cdiv class=\"aw-variant-hidden-subtitle-div\" id=\"aw-variant-subtitle-9783659385223\"\u003e\u003ch3\u003e\u003c\/h3\u003e\u003c\/div\u003e","brand":"Libri","offers":[{"title":"Softcover - 9783659385223","offer_id":39439437103197,"sku":"9783659385223","price":39.9,"currency_code":"EUR","in_stock":true}],"thumbnail_url":"\/\/cdn.shopify.com\/s\/files\/1\/0940\/0622\/files\/73e88319-8146-43fa-9caf-c2b2b9c5f7ca.jpg?v=1773469063","url":"https:\/\/shop.autorenwelt.de\/products\/molecular-modeling-of-inclusion-complexes-von-boubaker-hosouna-rohana-adnan","provider":"Autorenwelt Shop","version":"1.0","type":"link"}