Understanding the hydrogen transfer mechanism for the biodegradation of 2,4,6-trinitrotoluene catalyzed by pentaerythritol tetranitrate reductase: molecular dynamics simulations-Reference-Cited by-同舟云学术

Understanding the hydrogen transfer mechanism for the biodegradation of 2,4,6-trinitrotoluene catalyzed by pentaerythritol tetranitrate reductase: molecular dynamics simulations

Published:2018 Issue:17 Volume:20 Page:12157-12165
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Yang Zhilin¹²³⁴,Chen Junxian⁵⁶⁷⁸⁹,Zhou Yang¹²³⁴^ORCID,Huang Hui¹²³⁴,Xu Dingguo⁵⁶⁷⁸⁹^ORCID,Zhang Chaoyang¹²³⁴^ORCID

Affiliation:

1. Institute of Chemical Materials

2. Chinese Academy of Engineering and Physics

3. 621900 Mianyang

4. China

5. MOE Key Laboratory of Green Chemistry & Technology

6. College of Chemistry

7. Sichuan University

8. Chengdu

9. P. R. China

Abstract

The explosive 2,4,6-trinitrotoluene (TNT) is a highly toxic pollutant.

Funder

China Academy of Engineering Physics

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2018/CP/C8CP00345A

Reference57 articles.

1. Distribution and Fate of Military Explosives and Propellants in Soil: A Review

2. Exposure to nitroaromatic explosives and health effects during disposal of military waste

3. Occurrence of Urinary Tract Tumors in Miners Highly Exposed to Dinitrotoluene

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