The Computational Calculation and Molecular Docking of Aeroplysinin-1 As Antibacterial

Aeroplysinin-1 is naturally found from marine sponges as an anti-bacterial compound. Computational calculation and molecular docking were performed for aeroplysinin. Aeroplysinin as an inhibitor has optimized in the gas phase using DFT with 6-31G(d) functional. The structure from geometry optimizati...

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Bibliographic Details
Main Authors: Mirella Fonda Maahury, Veliyana Londong Allo
Format: Article
Language:English
Published: Department of Chemistry, Pattimura University 2021-09-01
Series:Indonesian Journal of Chemical Research
Subjects:
Online Access:https://ojs3.unpatti.ac.id/index.php/ijcr/article/view/4269