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Turkish Computational and Theoretical Chemistry
Vol: 3 Issue: 1
A theoretical investigation of TNT in different phases by using DFT
Faik Gökalp
Publication date :
2019-06-15
Density Functional Theory and Single Crystal X-ray Studies on Some Bis-Chalcone Derivatives
Gül Yakali
,
Abdullah Biçer
,
Duygu Barut
,
Günseli Turgut Cin
Publication date :
2019-06-15
Molecular docking study for evaluating the binding mode and interaction of 2, 4-disubstituted quiloline and its derivatives as potent anti-tubercular agents against Lipoate protein B (LipB)
Shola Elijah
,
Sani Uba
,
Adamu Uzairu
Publication date :
2019-06-15
MULTIVARIANT QSAR MODEL FOR SOME POTENT COMPOUNDS AS POTENTIAL ANTI-TUMOR INHIBITORS: A COMPUTATIONAL APPROACH
Shola Elijah
,
Sani Uba
,
Adamu Uzairu
Publication date :
2019-06-15
The amidine formed by tacrine and saccharin revisited: An ab initio Investigation of Structural, Electronic and Spectroscopic Properties
Nursel Acar
Publication date :
2019-06-15