Charge density distribution and electrostatic interactions of ethionamide: an inhibitor of the enoyl acyl carrier protein reductase (inhA) enzyme of Mycobacterium tuberculosis-Reference-Cited by-同舟云学术

Charge density distribution and electrostatic interactions of ethionamide: an inhibitor of the enoyl acyl carrier protein reductase (inhA) enzyme of Mycobacterium tuberculosis

Published:2014 Issue:101 Volume:4 Page:57823-57833
ISSN:2046-2069
Container-title:RSC Adv.
language:en
Short-container-title:RSC Adv.

Author:

Rajalakshmi G.¹²³⁴,Pavan Mysore S.⁵⁶⁷,Kumaradhas P.¹²³⁴

Affiliation:

1. Laboratory of Biocrystallography and Computational Molecular Biology

2. Department of Physics

3. Periyar University

4. Salem 636 011, India

5. Solid State and Structural Chemistry Unit

6. Indian Institute of Science

7. Bangalore 560 012, India

Abstract

The experimental and theoretical charge density analysis of ethionamide molecule provides the topological and the electrostatic properties, which allows the understanding of the nature of intra- and intermolecular interactions.

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2014/RA/C4RA07953A

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5. MOLECULAR MECHANISMS OF DRUG RESISTANCE IN MYCOBACTERIUM TUBERCULOSIS

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