Exploration of interaction behavior between spiro[indene-2,2'-[1,3,5]oxathiazine]-1,3-diones and DNA with the help of DFT, molecular docking, and MD simulations-Reference-Cited by-同舟云学术

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Exploration of interaction behavior between spiro[indene-2,2'-[1,3,5]oxathiazine]-1,3-diones and DNA with the help of DFT, molecular docking, and MD simulations

Published:2021-05-17 Issue: Volume: Page:1-21
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Salehpour Mahboobeh¹,Azizian Javad¹

Affiliation:

1. Department of Chemistry, Science and Research Branch, Islamic Azad University, Tehran, Iran

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2021.1924266

Reference54 articles.

1. Insights into the pharmacology of new heterocycles embedded with oxopyrrolidine rings: DNA binding, molecular docking, and anticancer studies

2. Facile synthesis of indole heterocyclic compounds based micellar nano anti-cancer drugs

3. Complexation of nicotinic acid with first generation poly(amidoamine) dendrimers: A microscopic view from density functional theory

4. Atomistic computer simulations on multi-loaded PAMAM dendrimers: a comparison of amine- and hydroxyl-terminated dendrimers

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1. Hederagenin improves Alzheimer's disease through PPARα/TFEB-mediated autophagy;Phytomedicine;2023-04

2. Assessment of Available AMBER Force Fields to Model DNA-Ligand Interactions;Biointerface Research in Applied Chemistry;2022-03-28

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