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Molecular Dynamics (MD) Applications in Materials Science and Engineering and Nanotechnology
(Articles)
Rishaad Khan
Journal of Materials Science and Chemical Engineering
Vol.11 No.11
,November 10, 2023
DOI:
10.4236/msce.2023.1111001
157
Downloads
724
Views
Citations
Application of a Pulsed Electric Field to Modify the Free Energy of the Active Site of an Azoreductase
(Articles)
Jesus Magyber de Jesus Miranda
,
Pedro Guillermo Reyes-Romero
,
Jorge Mulia-Rodríguez
,
Daniel Osorio-González
Journal of Applied Mathematics and Physics
Vol.12 No.1
,January 31, 2024
DOI:
10.4236/jamp.2024.121019
49
Downloads
149
Views
Citations
This article belongs to the Special Issue on
Application of Mathematical Models in Physics and Engineering
Structural Characterization of the D-Tyr-tRNA
Tyr
Deacylase from
Bacillus lichenformis
, an Organism of Great Industrial Importance
(Articles)
Angshuman Bagchi
Computational Molecular Bioscience
Vol.1 No.1
,December 28, 2011
DOI:
10.4236/cmb.2011.11001
2,662
Downloads
6,452
Views
Citations
A Study of thermal decomposition in cellulose by molecular dynamics simulation
(Articles)
Chao Liu
,
De-Zheng Jiang
,
Shun-An Wei
,
Jin-Bao Huang
Natural Science
Vol.1 No.1
,July 2, 2009
DOI:
10.4236/ns.2009.11008
7,078
Downloads
12,462
Views
Citations
Molecular dynamics simulations exploring the interaction between DNA and metalated bleomycin
(Articles)
Viraja R. Palwai
,
Leif A. Eriksson
Journal of Biophysical Chemistry
Vol.2 No.2
,June 2, 2011
DOI:
10.4236/jbpc.2011.22021
5,595
Downloads
10,474
Views
Citations
More Stable, More Estrogenic: The SERM-ERα LBD Complex
(Articles)
Li Gao
,
Yaoquan Tu
,
Leif A. Eriksson
Journal of Biophysical Chemistry
Vol.2 No.3
,August 9, 2011
DOI:
10.4236/jbpc.2011.23029
4,587
Downloads
8,479
Views
Citations
Pathogenicity characterization with implicit and explicit molecular dynamics simulation
(Articles)
Sigit Jaya Herlambang
,
Rosari Saleh
Natural Science
Vol.3 No.12
,December 16, 2011
DOI:
10.4236/ns.2011.312127
4,358
Downloads
7,993
Views
Citations
Molecular dynamics simulations of a DNA photolyase protein: High-mobility and conformational changes of the FAD molecule at low temperatures
(Articles)
Kholmirzo Kholmurodov
,
Ermuhammad Dushanov
,
Kenji Yasuoka
Advances in Bioscience and Biotechnology
Vol.3 No.3
,June 19, 2012
DOI:
10.4236/abb.2012.33025
5,605
Downloads
9,880
Views
Citations
Molecular Simulation of Ion Transport at the Water/Vapor Interface
(Articles)
Jalal Dweik
,
Mahmoud Srour
,
Khaled Karaky
,
Marwan Kobeissi
,
Wissam Joumaa
,
Khalil Abou-Saleh
Open Journal of Physical Chemistry
Vol.2 No.3
,August 31, 2012
DOI:
10.4236/ojpc.2012.23020
5,034
Downloads
9,072
Views
Citations
Molecular Dynamics Study on Mechanical Properties in the Structure of Self-Assembled Quantum Dot
(Articles)
Tatsuya Yamaguchi
,
Ken-ichi Saitoh
World Journal of Nano Science and Engineering
Vol.2 No.4
,December 14, 2012
DOI:
10.4236/wjnse.2012.24025
5,257
Downloads
7,736
Views
Citations
Validation of the CHARMM27 force field for nucleic acids using 2D nuclear overhauser effect spectroscopy
(Articles)
Kirill Zinovjev
,
Edvards Liepinsh
Journal of Biophysical Chemistry
Vol.4 No.2
,May 24, 2013
DOI:
10.4236/jbpc.2013.42008
3,032
Downloads
4,879
Views
Citations
Structure and Mechanical Behavior of Cellulose Nanofiber and Micro-Fibrils by Molecular Dynamics Simulation
(Articles)
Ken-ichi Saitoh
,
Haruhiko Ohno
,
Syunichiro Matsuo
Soft Nanoscience Letters
Vol.3 No.3
,July 16, 2013
DOI:
10.4236/snl.2013.33011
8,046
Downloads
10,695
Views
Citations
Biophysical Characterization of Genistein in Its Natural Carrier Human Hemoglobin Using Spectroscopic and Computational Approaches
(Articles)
Biswapathik Pahari
,
Sandipan Chakraborty
,
Bidisha Sengupta
,
Sudip Chaudhuri
,
William Martin
,
Jasmine Taylor
,
Jordan Henley
,
Donald Davis
,
Pradip K. Biswas
,
Amit K. Sharma
,
Pradeep K. Sengupta
Food and Nutrition Sciences
Vol.4 No.8A
,July 29, 2013
DOI:
10.4236/fns.2013.48A011
4,792
Downloads
7,211
Views
Citations
This article belongs to the Special Issue on
Antioxidant Research in Food Science
Evaluation of CDK6 and p16/INK4a-Derived Peptides Interaction
(Articles)
Andrey Kazennov
,
Andrey Alekseenko
,
Vladimir Bozhenko
,
Tatiana Kulinich
,
Nikolay Shuvalov
,
Yaroslav Kholodov
Computational Molecular Bioscience
Vol.3 No.3
,August 22, 2013
DOI:
10.4236/cmb.2013.33007
3,342
Downloads
5,887
Views
Citations
Conformational flexibility of the pharmacologically important insulin analogues
(Articles)
Olga Ksenofontova
,
Vasily Stefanov
Advances in Biological Chemistry
Vol.3 No.5
,October 30, 2013
DOI:
10.4236/abc.2013.35056
4,791
Downloads
7,104
Views
Citations
Molecular Dynamic Simulation Study on Glass Transition Temperature of DGEBA-THPA/SWCNTs Composites
(Articles)
Cai Jiang
,
Jianwei Zhang
,
Shaofeng Lin
,
Dazhi Jiang
Journal of Materials Science and Chemical Engineering
Vol.2 No.1
,January 15, 2014
DOI:
10.4236/msce.2014.21005
4,476
Downloads
7,797
Views
Citations
MD Simulated Microstructure of Liquid Sodium Alloyed with Lead
(Articles)
Inessa Yu. Shimkevich
,
Alexander L. Shimkevich
Materials Sciences and Applications
Vol.5 No.8
,June 27, 2014
DOI:
10.4236/msa.2014.58058
2,890
Downloads
3,970
Views
Citations
Temperature and Pressure Effects on Terahertz Time-Domain Spectroscopy of Crystalline Methedrine by Molecular Dynamics Simulation
(Articles)
Yu Xin
,
Hassan Yousefi Oderji
,
Ran Hai
,
Cailong Fu
,
Raja Aljarmouzi
,
Hongbin Ding
Advances in Molecular Imaging
Vol.4 No.4
,October 24, 2014
DOI:
10.4236/ami.2014.44007
3,638
Downloads
4,675
Views
Citations
DNA Methyltransferases Directed Anti-Cancerous Plant Medicine (Xanthomicrol and Galloyl) Based Molecular Docking and Dynamics Simulation
(Articles)
Ehsan Heidari Soureshjani
,
Ali Kazemi Babaheydari
,
Elahe Saberi
Computational Molecular Bioscience
Vol.5 No.2
,June 30, 2015
DOI:
10.4236/cmb.2015.52003
3,134
Downloads
3,966
Views
Citations
Investigation of Size Effects on the Al Nanoclusters Physical Properties via Molecular Dynamics Simulations
(Articles)
Mohammad Reza Sovizi
,
Ali Reza Madram
Open Access Library Journal
Vol.1 No.3
,June 11, 2014
DOI:
10.4236/oalib.1100473
2,429
Downloads
3,057
Views
Citations
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