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Title
Authors
Vol 90, No 11 (2016)
Solvent effect on the stability and properties of platinum-substituted borirene and boryl isomers: The polarizable continuum model
Ghiasi R., Peikari A.
PDF
(Eng)
Vol 90, No 9 (2016)
Density functional theory of tautomerism and water-assisted proton transfer of glycoluril
Beni A.S., Aazari M., Chermahini A.N., Zarandi M.
PDF
(Eng)
Vol 90, No 2 (2016)
Chemical structure and intra-molecular effects on NMR-NQR tensors of harmine and harmaline alkaloids
Ahmadinejad N., Tahan A., Talebi Tari M.
PDF
(Eng)
Vol 90, No 1 (2016)
The theoretical investigation of solvent effects on the relative stability and 15N NMR shielding of antidepressant heterocyclic drug
Tahan A., Khojandi M., Salari A.A.
PDF
(Eng)
Vol 92, No 9 (2018)
Theoretical Studies of Solvent Effect on the Structure, Вonding, and Spectroscopic Рroperties (IR, NMR) in the cis-[Pt(PH3)2(NCS)2] and [Pt(PH3)2(SCN)2] Linkage Isomers
Fatemeh Rezaeani , Ghiasi R., Yousefi M.
PDF
(Eng)
Vol 92, No 1 (2018)
DFT and MP2 Calculations on Tautomers and Water-Assisted Proton Transfer on 1,2,5-Oxadiazol-4,3-diamine
Beni A.S., Zarandi M., Hashemi A., Hosseinzadeh B., Chermahini A.N.
PDF
(Eng)
Vol 91, No 4 (2017)
Nuclear magnetic and nuclear quadrupole resonance parameters of β-carboline derivatives calculated using density functional theory
Ahmadinejad N., Tari M.T.
PDF
(Eng)
Vol 91, No 2 (2017)
Hydrogen bonds in ethylene glycol, monoethanolamine, and ethylenediamine complexes with water
Krest’yaninov M.A., Titova A.G., Zaichikov A.M.
PDF
(Eng)
1 - 8 of 8 Items

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