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List of works by Hossein Tavakol

AMBER Force Field Parameters for Cobalt-Containing Biological Systems: A Systematic Derivation Study

scientific article published on 22 January 2020

Antiproliferative activity of morpholine-based compounds on MCF-7 breast cancer, colon carcinoma C26 and normal fibroblast NIH-3T3 cell lines and study of their binding affinity to calfthymus-DNA and bovine serum albumin

article

Barrierless inter and intramolecular proton transfer; a DFT study of tautomerism in microsolvated and protonated systems

scientific article published on 25 July 2013

DFT and MP2 study of low barrier proton transfer in hydrazide schiff base tautomers via water bridges and in the gas

scientific article published on 25 May 2013

Investigation of structure, vibrational and NMR spectra of oxycodone and naltrexone: a combined experimental and theoretical study

scientific article published on 02 April 2011

Molecular dynamics study of biodegradation of azo dyes via their interactions with AzrC azoreductase

scientific article published on September 2015

New mixed ligand palladium(II) complexes based on the antiepileptic drug sodium valproate and bioactive nitrogen-donor ligands: synthesis, structural characterization, binding interactions with DNA and BSA, in vitro cytotoxicity studies and DFT calc

scientific article published on 28 January 2015

Pyrazinamide drug interacting with Co(III) and Zn(II) metal ions based on 2,2′-bipyridine and 1,10-phenanthroline ligands: Synthesis, studies and crystal structure, DFT calculations and antibacterial assays

Synthesis, spectroscopic and thermal studies of some IIB group complexes with a new N2-Schiff base ligand

scientific article published on 17 June 2011

Theoretical investigation of tautomerism in N-hydroxy amidines

scientific article published on 06 January 2009

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