Fariba Mollania
Fariba Mollania
Chemistry Department, Birjand University, Birjand, Iran
birjand.ac.ir üzerinde doğrulanmış e-posta adresine sahip
Başlık
Alıntı yapanlar
Alıntı yapanlar
Yıl
Immunosuppressive agent leflunomide: A SWNTs-immobilized dihydroortate dehydrogenase inhibitory effect and computational study of its adsorption properties on zigzag single …
H Raissi, F Mollania
European Journal of Pharmaceutical Sciences 56, 37-54, 2014
332014
Ab initio and DFT computational studies on molecular conformations and strength of the intramolecular hydrogen bond in different conformers of 3-amino-2-iminomethyl acryl aldehyde
H Raissi, M Yoosefian, F Mollania, F Farzad, AR Nowroozi
Computational and Theoretical Chemistry 966 (1-3), 299-305, 2011
322011
Comprehensive study of the interaction between hydrogen halides and methanol derivatives
H Raissi, M Yoosefian, F Mollania
International Journal of Quantum Chemistry 112 (16), 2782-2786, 2012
282012
Hydrogen bond studies in substituted imino-acetaldehyde oxime
H Raissi, M Yoosefian, F Mollania
Computational and theoretical chemistry 996, 68-75, 2012
262012
Ab initio and DFT studies on 1-(thionitrosomethylene) hydrazine: conformers, energies, and intramolecular hydrogen-bond strength
H Raissi, A Khanmohammadi, M Yoosefian, F Mollania
Structural Chemistry 24 (4), 1121-1133, 2013
232013
Electronic structures, intramolecular interactions, and aromaticity of substituted 1-(2-iminoethylidene) silan amine: a density functional study
H Raissi, M Yoosefian, F Mollania, S Khoshkhou
Structural Chemistry 24 (1), 123-137, 2013
232013
Molecular structure and bonding character of mono and divalent metal cations (Li+, Na+, K+, Be2+, Mg2+, and Ca2+) with substituted benzene derivatives: AIM …
A Khanmohammadi, H Raissi, F Mollania, L Hokmabadi
Structural Chemistry 25 (5), 1327-1342, 2014
182014
Electronic structures, intramolecular hydrogen bond interaction, and aromaticity of substituted 4-amino-3-penten-2-one in ground and electronic excited state
M Shahabi, H Raissi, F Mollania
Structural Chemistry 26 (2), 491-506, 2015
162015
The effect of substitution on structure, intramolecular hydrogen bonding strength, electron density and resonance in 3-amino 2-iminomethyl acryl aldehyde
H Raissi, M Yoosefian, F Mollania, F Farzad
Journal of Theoretical and Computational Chemistry 11 (05), 925-939, 2012
162012
Solvent effects on the structural, electronic properties and intramolecular N–HO hydrogen bond strength of 5-aminomethylene-pyrimidine-2, 4, 6 trion with DFT calculations
S Pasban, H Raissi, F Mollania
Journal of Molecular Liquids 215, 77-87, 2016
112016
Molecular structure, conformational stability, energetic and intramolecular hydrogen bonding in ground, and electronic excited state of 3-mercapto propeneselenal
M Shokhmkar, H Raissi, F Mollania
Structural Chemistry 25 (4), 1153-1164, 2014
112014
CONFORMATIONAL PROPERTIES AND INTRAMOLECULAR HYDROGEN BONDING OF 3-AMINO-PROPENESELENAL: AN AB INITIO AND DENSITY …
H Raissi, F Farzad, S Eslamdoost, F Mollania
Journal of Theoretical and Computational Chemistry 12 (04), 1350025, 2013
102013
The analysis of structural and electronic properties for assessment of intramolecular hydrogen bond (IMHB) interaction: a comprehensive study into the effect of substitution on …
H Raissi, Z Khoshbin, F Mollania
Structural Chemistry 25 (2), 515-538, 2014
92014
Evaluation of solvent and ion effects upon leflunomide adsorption characteristics on (6, 0) zigzag single-walled carbon nanotube and immobilized dihydroorotate dehydrogenase …
F Mollania, H Raissi
Journal of Molecular Liquids 231, 528-541, 2017
72017
A Theoretical DFT Study on the Structural Parameters and Intramolecular Hydrogen-Bond Strength in Substituted (Z)-N-(Thionitrosomethylene)thiohydroxylamine …
H Raissi, A Khanmohammadi, F Mollania
Bulletin of the Chemical Society of Japan 86 (11), 1261-1271, 2013
62013
Theoretical study of substituents effects on characteristics of resonance-assisted hydrogen bond in (Z)-(thionitrosomethylene) hydrazine and its derivatives in ground and …
F Mollania, H Raissi
Structural Chemistry 25 (4), 1099-1109, 2014
52014
Modeling the interaction between anti-cancer drug penicillamine and pristine and functionalized carbon nanotubes for medical applications: density functional theory …
H Shaki, H Raissi, F Mollania, H Hashemzadeh
Journal of Biomolecular Structure and Dynamics 38 (5), 1322-1334, 2020
22020
Quantum chemical study on influence of the substitution effect on the structural and electronic properties and intramolecular hydrogen bonding of 2-nitrophenyl hydrosulfide in …
H Heydari, H Raissi, F Mollania
Structural Chemistry 26 (4), 971-987, 2015
22015
Structural, electronic properties and intramolecular hydrogen bonding of substituted 2-[(E)-imino methyl] benzenethiol in ground and first excited state by quantum chemical methods
SJS Moosavi, H Raissi, F Mollania
Structural Chemistry 25 (4), 1187-1196, 2014
12014
Molecular structure, vibrational assignments, conformational stability, ground and excited state hydrogen-bonding analysis of 2-nitroso vinyl amine
F Mollania, H Raissi
Journal of Theoretical and Computational Chemistry 12 (07), 1350072, 2013
12013
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Makaleler 1–20