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Computational Chemistry
Submission
Computational Chemistry
ISSN Print:
2332-5968
ISSN Online:
2332-5984
www.scirp.net/journal/cc
E-mail:
[email protected]
Google-based Impact Factor:
0.82
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ONIOM Method Characterization of Hydrogen Bonding Sites of Mycolactone A/B, a Buruli Ulcer Toxin
()
Kadjo François Kassi
,
Mamadou Guy-Richard Koné
,
Sopi Thomas Affi
,
Nahossé Ziao
Computational Chemistry
Vol.5 No.3
, July 11, 2017
DOI:
10.4236/cc.2017.53009
1,205
Downloads
2,476
Views
Citations
This article belongs to the Special Issue on
Quantum Chemical Characterization of Hydrogen Bonding Sites in Three 4-(4-Halo-Phenyl)-6-(Furan-2-yl) Pyrimidin-2-Amine Derivatives
()
Yafigui Traore
,
Kafoumba Bamba
,
Nahossé Ziao
,
Sopi Thomas Affi
,
Mamadou Guy-Richard Kone
Computational Chemistry
Vol.5 No.3
, July 5, 2017
DOI:
10.4236/cc.2017.53008
1,446
Downloads
2,765
Views
Citations
This article belongs to the Special Issue on
Theoretical Investigation of the Newly Designed Benzimidazole Based Metal Mediated DNA Base Couples with DFT Method
()
Fatma Sevin
,
Mostafa Asghari Dilmani
,
Kübra Sarıkavak
,
Samira Farshbaf Jeddi
Computational Chemistry
Vol.5 No.2
, April 30, 2017
DOI:
10.4236/cc.2017.52007
1,594
Downloads
2,860
Views
Citations
This article belongs to the Special Issue on
Comparative Study of the Chemical Reactivity of Helical Peptide Models for Protein Glycation
()
Juan Frau
,
Daniel Glossman-Mitnik
Computational Chemistry
Vol.5 No.2
, April 28, 2017
DOI:
10.4236/cc.2017.52006
1,442
Downloads
2,713
Views
Citations
This article belongs to the Special Issue on
NBO Population Analysis and Electronic Calculation of Four Azopyridine Ruthenium Complexes by DFT Method
()
N’Guessan Kouakou Nobel
,
Kafoumba Bamba
,
Ouattara Wawohinlin Patrice
,
Nahossé Ziao
Computational Chemistry
Vol.5 No.1
, January 19, 2017
DOI:
10.4236/cc.2017.51005
3,401
Downloads
7,067
Views
Citations
This article belongs to the Special Issue on
Quantum Chemistry Prediction of Molecular Lipophilicity Using Semi-Empirical AM1 and
Ab Initio
HF/6-311++G Levels
()
Ouanlo Ouattara
,
Nahossé Ziao
Computational Chemistry
Vol.5 No.1
, January 19, 2017
DOI:
10.4236/cc.2017.51004
2,111
Downloads
3,958
Views
Citations
This article belongs to the Special Issue on
A Theoretical Investigation of Gas Phase OH-Initiated Acenaphthylene Degradation Reaction
()
Xin Mao
,
Sufan Wang
,
Yucheng Huang
,
Tao Zhou
Computational Chemistry
Vol.5 No.1
, January 6, 2017
DOI:
10.4236/cc.2017.51003
2,134
Downloads
3,906
Views
Citations
This article belongs to the Special Issue on
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