The influence of cation–π and anion–π interactions on some NMR data of s-triazine… HF hydrogen bonding: A theoretical study HR Masoodi, S Bagheri, M Mohammadi, M Zakarianezhad, B Makiabadi Chemical Physics Letters 588, 31-36, 2013 | 24 | 2013 |
Influence of substitution on the strength and nature of CH···N hydrogen bond in XCCH···NH3 complexes H Roohi, S Bagheri International Journal of Quantum Chemistry 111 (5), 961-969, 2011 | 16 | 2011 |
The effects of tautomerization and protonation on the adenine–cytosine mismatches: a density functional theory study HR Masoodi, S Bagheri, M Abareghi Journal of Biomolecular Structure and Dynamics 34 (6), 1143-1155, 2016 | 14 | 2016 |
Theoretical study of cooperativity between hydrogen bond‒hydrogen bond, halogen bond‒halogen bond and hydrogen bond‒halogen bond in ternary FX… diazine… XF (X= H and Cl … HR Masoodi, S Bagheri, M Ranjbar Molecular Physics 114 (23), 3464-3474, 2016 | 12 | 2016 |
Theoretical study of the influence of cation-π and anion-π interactions on some NMR data of borazine complexes S Bagheri, HR Masoodi Chemical Physics Letters 629, 46-52, 2015 | 11 | 2015 |
Exploring the role of substituents on cooperativity between N⋯ HF and CH⋯ F hydrogen bonds in ternary systems involving aromatic azine: substituted complexes of s-triazine: HF … S Bagheri, HR Masoodi, A Yousofvand Computational and Theoretical Chemistry 1092, 12-18, 2016 | 9 | 2016 |
Theoretical prediction of some novel nanotubes composed of macrocyclic structures: A DFT study HR Masoodi, S Bagheri, R Ranjbar-Karimi Chemical Physics Letters 667, 327-331, 2017 | 8 | 2017 |
The influence of cations and anions on some structural and electronic properties of single-walled zigzag boron nitride and aluminum nitride nanotubes: a computational study HR Masoodi, A Ebrahimi, S Bagheri Structural Chemistry 26, 1013-1024, 2015 | 8 | 2015 |
Substituent effects on some calculated NMR data in T-shaped configuration of benzene dimer HR Masoodi, M Zakarianezhad, S Bagheri, B Makiabadi, M Shool Chemical Physics Letters 614, 143-147, 2014 | 8 | 2014 |
The influence of number of nitrogen atoms on the NMR data in aromatic azine⋯ HF complexes S Bagheri, HR Masoodi, M Mohammadi, M Zakarianezhad, B Makiabadi Chemical Physics Letters 572, 26-31, 2013 | 8 | 2013 |
Estimation of individual NH··· X (X= N, O) hydrogen bonding energies in some complexes involving multiple hydrogen bonds using NBO calculations S Bagheri, HR Masoodi, MN Abadi Theoretical Chemistry Accounts 134, 1-8, 2015 | 6 | 2015 |
Interplay between π··· π stacking and cation··· π interaction: a theoretical NMR study HR Masoodi, S Bagheri Journal of the Iranian Chemical Society 12 (10), 1883-1892, 2015 | 6 | 2015 |
The influence of carbon hybridization on coupling constants across CX⋯ ClF dihalogen bond: a computational study HR Masoodi, S Bagheri Chemical Physics Letters 637, 153-158, 2015 | 6 | 2015 |
Intermolecular interactions in uracil–nitrous acid complexes: structures, binding energy, topological properties, and nuclear magnetic resonance study B Makiabadi, M Zakarianejad, S Bagheri, HR Masoodi, RS Aghaie International Journal of Quantum Chemistry 113 (21), 2361-2371, 2013 | 5 | 2013 |
The role of nature of aromatic ring on cooperativity between π–π stacking and ion–π interactions: a computational study HR Masoodi, RS Pourhosseini, S Bagheri Computational and Theoretical Chemistry 1220, 114022, 2023 | 4 | 2023 |
The influence of Cu+ binding to hypoxanthine on stabilization of mismatches involving hypoxanthine and DNA bases: a DFT study HR Masoodi, S Bagheri, Z Ghaderi Journal of Biomolecular Structure and Dynamics 37 (8), 1923-1934, 2019 | 4 | 2019 |
Theoretical study of physicochemical properties of ionic liquid [mim][C(CN)3] B Makiabadi, M Zakarianezhad, HR Masoodi, S Bagheri, F Noormandi Chemistry of Heterocyclic Compounds 52, 244-252, 2016 | 4 | 2016 |
Theoretical study of hydrogen bonds and electronic properties in hexagonal arrangements composed of self-assembled DNA analogues S Bagheri Structural Chemistry 31 (5), 2075-2085, 2020 | 3 | 2020 |
DFT study of adenine–cytosine mismatch in quaternary systems involving DNA bases HR Masoodi, S Bagheri, Z Anvari Structural Chemistry 30 (3), 1023-1031, 2019 | 3 | 2019 |
The influence of substituents on cooperativity between CH···π and N···H hydrogen bonds in a T-shaped configuration: X-benzene⊥(FH···pyrazine···HF) complexes … HR Masoodi, S Bagheri, S Saeednia, M Mohammadi, AR Raeisipoor Structural Chemistry 27, 1521-1530, 2016 | 3 | 2016 |