Search filters

List of works by Mahmoud Mirzaei

A density functional study of (17)O, (14)N and (2)H electric field gradient tensors in the real crystalline structure of alpha-glycine

scientific article published on 17 August 2006

A molecular modelling study of the effects of pivalate ligand substitutions on the magnetic properties of chromium-wheels host complexes

scientific article published on 19 November 2018

A systematic investigation of hydrogen-bonding effects on the 17O, 14N, and 2H nuclear quadrupole resonance parameters of anhydrous and monohydrated cytosine crystalline structures: a density functional theory study

scientific article published on 01 June 2006

An investigation of hydrogen-bonding effects on the nitrogen and hydrogen electric field gradient and chemical shielding tensors in the 9-methyladenine real crystalline structure: a density functional theory study.

scientific article published in April 2006

Biological evaluation, docking and molecular dynamic simulation of some novel diaryl urea derivatives bearing quinoxalindione moiety

scientific article published in December 2017

Carbon doped boron phosphide nanotubes: a computational study

scientific article published on 09 April 2010

Covalent hybridization of CNT by thymine and uracil: a computational study

scientific article published on 08 June 2010

Density functional calculations of oxygen, nitrogen and hydrogen electric field gradient and chemical shielding tensors to study hydrogen bonding properties of peptide group (O=C-NH) in crystalline acetamide

scientific article published on 19 August 2007

Inhibitory effects of curcumin on aldose reductase and cyclooxygenase-2 enzymes

scientific article published on 31 July 2020

Investigating purine-functionalised carbon nanotubes and their properties: a computational approach

scientific article published on 01 June 2011

Investigation of C-H...O=C and N-H...OC hydrogen-bonding interactions in crystalline thymine by DFT calculations of O-17, N-14 and H-2 NQR parameters

scientific article published on 25 October 2006

Paulina is supported by:

About Paulina

Help