Computational insight into networking H‐bonds in open and cyclic forms of glucose
Kotena, Zahrabatoul Mosapour, Fattahi, Alireza
Published in Journal of physical organic chemistry (01.01.2022)
Published in Journal of physical organic chemistry (01.01.2022)
Get full text
Journal Article
Influence of H‐bonds on acidity of deoxy‐hexose sugars
Kotena, Zahrabatoul Mosapour, Fattahi, Alireza
Published in Journal of physical organic chemistry (01.10.2020)
Published in Journal of physical organic chemistry (01.10.2020)
Get full text
Journal Article
Adsorption behaviors of carbon monoxide (CO) over aromatic magnesium nanoclusters: a DFT study
Dehghan, Mahmood Reza, Ahmadi, Sara, Kotena, Zahrabatoul Mosapour
Published in Structural chemistry (01.10.2021)
Published in Structural chemistry (01.10.2021)
Get full text
Journal Article
AIM and NBO analyses on hydrogen bonds formation in sugar-based surfactants (α/β-d-mannose and n-octyl-α/β-d-mannopyranoside): a density functional theory study
Mosapour Kotena, Zahrabatoul, Behjatmanesh-Ardakani, Reza, Hashim, Rauzah
Published in Liquid crystals (03.06.2014)
Published in Liquid crystals (03.06.2014)
Get full text
Journal Article
Computational insight into networking H-bonds in open and cyclic forms of galactose
Kotena, Zahrabatoul Mosapour, Fattahi, Alireza
Published in Journal of molecular structure (05.05.2022)
Published in Journal of molecular structure (05.05.2022)
Get full text
Journal Article
Bifurcated hydrogen bond in rare sugar by computational study
Kotena, Zahrabatoul Mosapour, Mohamad, Saharuddin Bin
Published in Molecular Crystals and Liquid Crystals (24.03.2017)
Published in Molecular Crystals and Liquid Crystals (24.03.2017)
Get full text
Journal Article
DFT-B3LYP study of interactions between host biphenyl-1-aza-18-crown-6 ether derivatives and guest Cd2+: NBO, NEDA, and QTAIM analyses
Behjatmanesh-Ardakani, R., Pourroustaei-Ardakani, F., Taghdiri, M., Kotena, Zahrabatoul Mosapour
Published in Journal of molecular modeling (01.07.2016)
Published in Journal of molecular modeling (01.07.2016)
Get full text
Journal Article
DFT-B3LYP study of interactions between host biphenyl-1-aza-18-crown-6 ether derivatives and guest Cd(2+): NBO, NEDA, and QTAIM analyses
Behjatmanesh-Ardakani, R, Pourroustaei-Ardakani, F, Taghdiri, M, Kotena, Zahrabatoul Mosapour
Published in Journal of molecular modeling (01.07.2016)
Published in Journal of molecular modeling (01.07.2016)
Get full text
Journal Article