A DFT and molecular docking study of xerantholide and its interaction with Neisseria gonorrhoeae carbonic anhydrase

Author:

Nyambe Moola M.,Archibong Edet F.,Chinsembu Kazhila C.

Funder

University of Namibia

Publisher

Elsevier BV

Subject

Computational Mathematics,Organic Chemistry,Biochemistry,Structural Biology

Reference36 articles.

1. In vivo efficacy of acetazolamide in a mouse model of Neisseria gonorrhoeae infection;Abutaleb;Microb Pathog.,2022

2. Synthesis and conformational analysis of sterically congested (4 R)-(-)-1-(2,4,6-trimethylbenzenesulfonyl)-3- n -butyryl-4- tert -butyl-2-imidazolidinone: X-ray crystallography and semiempirical calculations;Al-Swaidan;J. Chem.,2014

3. Carbonic anhydrases: versatile and useful biocatalysts in chemistry and biochemistry;Angeli;Catalysts,2020

4. Synthesis and characterization of curcumin-sulfonamide hybrids: biological evaluation and molecular docking studies;Banuppriya;J. Mol. Struct.,2018

5. BIOVIA D.S. Discovery Studio Visualizer,. San Diego: Dassault Systèmes. (2019). https://3ds.com/products-services/biovia/products.

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