The presentation of an approach for estimating the intramolecular hydrogen bond strength in conformational study of β-Aminoacrolein AR Nowroozi, H Raissi, F Farzad Journal of Molecular Structure: THEOCHEM 730 (1-3), 161-169, 2005 | 93 | 2005 |
H-bonded complexes of uracil with parent nitrosamine: a quantum chemical study H Roohi, AR Nowroozi, E Anjomshoa Computational and Theoretical Chemistry 965 (1), 211-220, 2011 | 92 | 2011 |
Boron nitride nanotubes for delivery of 5-fluorouracil as anticancer drug: a theoretical study K Shayan, A Nowroozi Applied Surface Science 428, 500-513, 2018 | 51 | 2018 |
Reinvestigation of intramolecular hydrogen bond in malonaldehyde derivatives: an ab initio, AIM and NBO study A Nowroozi, H Raissi, H Hajiabadi, PM Jahani International Journal of Quantum Chemistry 111 (12), 3040-3047, 2011 | 47 | 2011 |
Strong intramolecular hydrogen bond in triformylmethane ab-initio, AIM and NBO study A Nowroozi, H Raissi Journal of Molecular Structure: THEOCHEM 759 (1-3), 93-100, 2006 | 47 | 2006 |
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 | 44 | 2011 |
Substituent effect on structure, electron density, and intramolecular hydrogen bonding in nitroso‐oxime methane M Yoosefian, H Raissi, ES Nadim, F Farzad, M Fazli, E Karimzade, ... International Journal of Quantum Chemistry 111 (14), 3505-3516, 2011 | 43 | 2011 |
Intramolecular hydrogen bonding in structural conformers of 2‐amino methylene malonaldehyde: AIM and NBO studies H Raissi, AF Jalbout, M Yoosefian, M Fazli, A Nowroozi, M Shahinin, ... International Journal of Quantum Chemistry 110 (4), 821-830, 2010 | 43 | 2010 |
The effects of substitutions on structure, electron density, resonance and intramolecular hydrogen bonding strength in 3-mercapto-propenethial H Raissi, ES Nadim, M Yoosefian, F Farzad, E Ghiamati, AR Nowroozi, ... Journal of Molecular Structure: THEOCHEM 960 (1-3), 1-9, 2010 | 37 | 2010 |
Molecular structure and vibrational assignment of (trifluoroacetyl) acetone: A density functional study H Raissi, A Nowroozi, M Roozbeh, F Farzad Journal of molecular structure 787 (1-3), 148-162, 2006 | 35 | 2006 |
Fourier transforms infrared spectra and structure of triformylmethane. A density functional theoretical study A Nowroozi, SF Tayyari, H Rahemi Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 59 (8 …, 2003 | 29 | 2003 |
The competition between the intramolecular hydrogen bond and π‐electron delocalization in trifluoroacetylacetone—A theoretical study A Nowroozi, H Roohi, MS Sadeghi Ghoogheri, M Sheibaninia International Journal of Quantum Chemistry 111 (3), 578-585, 2011 | 27 | 2011 |
Hydrogen adsorption on SiC nanotube under transverse electric field E Masumian, SM Hashemianzadeh, A Nowroozi Physics Letters A 378 (34), 2549-2552, 2014 | 24 | 2014 |
Kinetic study, structural analysis and computational investigation of novel xerogel based on drug-PEG/SiO2 for controlled release of enrofloxacin AA Rafati, A Ebadi, S Bavafa, A Nowroozi Journal of Molecular Liquids 266, 733-742, 2018 | 21 | 2018 |
OH··· O and OH··· S intramolecular interactions in simple resonance-assisted hydrogen bond systems: a comparative study of various models A Nowroozi, H Hajiabadi, F Akbari Structural Chemistry 25, 251-258, 2014 | 21 | 2014 |
Hydrogen bonding in acetylacetaldehyde: Theoretical insights from the theory of atoms in molecules A Nowroozi, AF Jalbout, H Roohi, E Khalilinia, M Sadeghi, A De Leon, ... International Journal of Quantum Chemistry 109 (7), 1505-1514, 2009 | 20 | 2009 |
Second transurethral resection of bladder tumor: is it necessary in all T1 and/or high-grade tumors? M Ayati, E Amini, RS Damavand, MR Nowroozi, M Soleimani, E Ranjbar, ... Urology Journal 16 (2), 152-156, 2019 | 19 | 2019 |
On the performance of resonance assisted hydrogen bond theory in malonaldehyde derivatives E Nakhaei, A Nowroozi Computational and Theoretical Chemistry 1096, 27-32, 2016 | 19 | 2016 |
Theoretical study of the effects of substitution, solvation, and structure on the interaction between nitriles and methanol H Raissi, F Farzad, ES Nadim, M Yoosefian, H Farsi, A Nowroozi, ... International Journal of Quantum Chemistry 112 (5), 1273-1284, 2012 | 19 | 2012 |
OH⋯ S intramolecular hydrogen bond in thiomalonaldehyde derivatives; a quantum chemical study A Nowroozi, H Roohi, H Hajiabadi, H Raissi, E Khalilinia, MN Birgan Computational and Theoretical Chemistry 963 (2-3), 517-524, 2011 | 18 | 2011 |