In silico molecular GRIP docking studies of antioxidant potentials of black tea compounds

Koushik Bhandari; Baishakhi De

doi:10.3390/mol2net-03-05045

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In silico molecular GRIP docking studies of antioxidant potentials of black tea compounds

Koushik Bhandari

¹,

Baishakhi De

^{*

2}

¹ School of Medical Science & Technology, IIT Kharagpur-721302, India
² SSS Indira College of Pharmacy, Vishnupuri, Nanded- 431606, India

Published: 28 November 2017 by MDPI in MOL2NET'17, Conference on Molecular, Biomed., Comput. & Network Science and Engineering, 3rd ed. congress USEDAT-03: USA-EU Data Analysis Training Prog. Work., Cambridge, UK-Bilbao, Spain-Duluth, USA, 2017

https://doi.org/10.3390/mol2net-03-05045

Abstract:

Black tea is a very widely accepted and popular beverage that has attracted the research limelight and has exhibited multifaceted health effects due to the presence of wide range of pharmacologically active molecules. This paper aims to explore the antioxidant potentials of black tea catechins by in silico molecular GRIP docking studies. Basing on the result of dock score epicatechin gallate, catechin, epicatechin, epigallocatechin gallate all exhibited significant antioxidant potentials against the targeted enzymes.

Keywords: black tea; beverage; antioxidant; GRIP docking; dock score

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Baishakhi De