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Journal
Affiliation
ISSN
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Interaction of Cationic and Anionic Phthalocyanines with Adenosine Deaminase, Molecular Dynamics Simulation and Docking Studies
(Articles)
Davood Ajloo
,
Seyyed Morteza Fazeli
,
Farhad Janbaz Amirani
Computational Molecular Bioscience
Vol.3 No.4
,December 19, 2013
DOI:
10.4236/cmb.2013.34010
5,535
Downloads
9,832
Views
Citations
Study on the Interactions of Two Isomer Selaginellins as Novel Small Molecule Inhibitors Targeting PTP1B by Docking and Molecular Dynamics Simulations
(Articles)
Li Wang
,
Yi Wang
,
Dan Meng
,
Honglei Li
Open Access Library Journal
Vol.5 No.2
,February 27, 2018
DOI:
10.4236/oalib.1104277
641
Downloads
1,651
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
169
Views
Citations
This article belongs to the Special Issue on
Application of Mathematical Models in Physics and Engineering
Prediction of a neutralizing epitope of a H5N1 virus hemagglutinin complexed with an antibody variable fragment using molecular dynamics simulation
(Articles)
Cenmidtal C. Mulyanto
,
Rosari Saleh
Journal of Biophysical Chemistry
Vol.2 No.3
,August 9, 2011
DOI:
10.4236/jbpc.2011.23031
4,501
Downloads
8,782
Views
Citations
Molecular Modeling and Molecular Dynamics Simulation Studies on the Selective Binding Mechanism of MTHFD2 Inhibitors
(Articles)
Mengyang Qu
Computational Molecular Bioscience
Vol.12 No.1
,March 7, 2022
DOI:
10.4236/cmb.2022.121001
385
Downloads
1,277
Views
Citations
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
2,661
Downloads
6,517
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
7,721
Views
Citations
This article belongs to the Special Issue on
Antioxidant Research in Food Science
Insight of Natural Compounds Halimane Diterpenoids against
Mycobacterium tuberculosis
: Virtual Screening, DFT, Drug-Likeness, and Molecular Dynamics Approach
(Articles)
Laurent Gael Eyia Andiga
,
Boris Davy Bekono
,
Désiré Mama Bikele
,
Pie Pascal Onguéné Amoa
,
Luc Calvin Owono Owono
,
Luc Léonard Mbaze Meva’a
Computational Molecular Bioscience
Vol.14 No.2
,May 7, 2024
DOI:
10.4236/cmb.2024.142003
33
Downloads
122
Views
Citations
Structural analyses of the interactions of SoxY and SoxZ from thermo-neutrophilic
Hydrogenobacter thermophilus
(Articles)
Angshuman Bagchi
,
Tapash Chandra Ghosh
Journal of Biophysical Chemistry
Vol.2 No.4
,November 9, 2011
DOI:
10.4236/jbpc.2011.24047
4,451
Downloads
7,677
Views
Citations
Molecular docking investigation for Indonesian H274Y mutant neuraminidase type 1 with neuraminidase inhibitors
(Articles)
Sigit Jaya Herlambang
,
Rosari Saleh
American Journal of Molecular Biology
Vol.2 No.1
,December 30, 2011
DOI:
10.4236/ajmb.2012.21006
4,423
Downloads
9,890
Views
Citations
Insilico
studies of 2-methylheptyl isonicotinate produced by
Streptomyces
sps. 201 against dihydrodipicolinate synthase enzyme of
Mycobacterium tuberculosis
(Articles)
Salam Pradeep Singh
,
Rajib Lochan Bezbaruah
,
Tarun Chandra Bora
Journal of Biophysical Chemistry
Vol.3 No.3
,August 28, 2012
DOI:
10.4236/jbpc.2012.33027
29,045
Downloads
94,836
Views
Citations
In Silico Docking of Rhodanine Derivatives and 3D-QSAR Study to Identify Potent Prostate Cancer Inhibitors
(Articles)
Koffi Alexis Respect Kouassi
,
Adenidji Ganiyou
,
Diomande Gbe Gondo Didier
,
Anoubilé Benié
,
Ziao Nahossé
Computational Chemistry
Vol.10 No.2
,February 18, 2022
DOI:
10.4236/cc.2022.102002
242
Downloads
1,305
Views
Citations
Quantum molecular dynamics simulation formultifragmentation resulting from an expandingnuclear matter
(Articles)
Atef Abdel-hafiez
,
M. A. Khalifa
,
A. Abd El-Daiem
Natural Science
Vol.3 No.7
,July 25, 2011
DOI:
10.4236/ns.2011.37082
4,814
Downloads
8,824
Views
Citations
Molecular Modeling, Docking and ADMET of Dimethylthiohydantoin Derivatives for Prostate Cancer Treatment
(Articles)
Khaled Lotfy
Journal of Biophysical Chemistry
Vol.6 No.4
,November 4, 2015
DOI:
10.4236/jbpc.2015.64010
6,273
Downloads
8,281
Views
Citations
In
Silico
Screening of Potential Inhibitors against dPLA2 from Named Chinese Herbs for Identification of Compounds with Antivenom Effects Due to
Deinagkistrodon acutus
Snake Bites
(Articles)
Xingyang Xiao
,
Mengyi Lai
,
Zechang Rao
,
Jianzhong Huang
,
Yiwei Xie
,
Hongbin Zhang
American Journal of Molecular Biology
Vol.14 No.3
,May 15, 2024
DOI:
10.4236/ajmb.2024.143009
33
Downloads
120
Views
Citations
Screening of Potent Inhibitor of H1N1 Influenza NS1 CPSF30 Binding Pocket by Molecular Docking
(Articles)
Li Zhang
,
Jian Zhao
,
Guowei Ding
,
Xuejiao Li
,
Hongsheng Liu
Advances in Infectious Diseases
Vol.2 No.4
,December 5, 2012
DOI:
10.4236/aid.2012.24015
4,606
Downloads
8,521
Views
Citations
Anti-Cancer Activity and Molecular Docking of Some Pyrano[3,2‑c]quinoline Analogues
(Articles)
Abdeltawab M. Saeed
,
Ibrahim M. Abdou
,
Alaa A. Salem
,
Mohammad A. Ghattas
,
Noor Atatreh
,
Shaikha S. AlNeyadi
Open Journal of Medicinal Chemistry
Vol.10 No.1
,March 5, 2020
DOI:
10.4236/ojmc.2020.101001
805
Downloads
2,554
Views
Citations
Spectral Modifications of Graphene Using Molecular Dynamics Simulations
(Articles)
David Liesegang
,
Christina Oligschleger
Journal of Modern Physics
Vol.5 No.4
,February 21, 2014
DOI:
10.4236/jmp.2014.54025
4,183
Downloads
6,956
Views
Citations
This article belongs to the Special Issue on
Molecular Dynamics Method
Molecular Dynamics Simulation of Mechanical Properties for α-SiO
2
Crystal
(Articles)
Jierong Guo
,
Lei Ma
Journal of Modern Physics
Vol.10 No.6
,April 26, 2019
DOI:
10.4236/jmp.2019.106040
1,068
Downloads
2,376
Views
Citations
Changes in Adenosine Metabolism in Asthma. A Study on Adenosine, 5'-NT, Adenosine Deaminase and Its Isoenzyme Levels in Serum, Lymphocytes and Erythrocytes
(Articles)
Jitender Sharma
,
Bala K. Menon
,
Vannan K. Vijayan
,
Surendra K. Bansal
Open Journal of Respiratory Diseases
Vol.5 No.2
,March 19, 2015
DOI:
10.4236/ojrd.2015.52004
4,264
Downloads
5,417
Views
Citations
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