نتایج جستجو برای: binding parameters

تعداد نتایج: 986561  

Journal: :international journal of nano dimension 0
s. rahimnejad 1department of chemistry, islamic azad university-shahre rey branch, tehran, iran. m. mirzaei department of chemistry, islamic azad university-lahijan branch, lahijan, iran.

density functional theory (dft) calculations were performed to investigate the properties of planar, tubular and conical forms of silicon nanostructures. the evaluated parameters including averaged bond lengths, binding energies, gap energies and dipole moments were then evaluated for the optimized models of study. the results indicated that the bond lengths between silicon atoms are different ...

Journal: :Rinsho yakuri/Japanese Journal of Clinical Pharmacology and Therapeutics 1990

A Divsalar AA Moosavi Movahedi AA Saboury GH Ataie S Bagheri S Namaki SH Safarian

The effects of allopurinol, acyclovir and theophylline on the activity of adenosine deaminase (ADA) were studied in 50 mM sodium phosphate buffer pH 7.5 at 27°C, using a UV– Vis spectrophotometer. Adenosine deaminase is inhibited by these ligands, via different types of inhibition. Allopurinol, as a transition state analog of xanthine oxidase, and acyclovir competitively inhibit the catalytic a...

A Divsalar AA Moosavi Movahedi AA Saboury GH Ataie S Bagheri S Namaki SH Safarian

The effects of allopurinol, acyclovir and theophylline on the activity of adenosine deaminase (ADA) were studied in 50 mM sodium phosphate buffer pH 7.5 at 27°C, using a UV– Vis spectrophotometer. Adenosine deaminase is inhibited by these ligands, via different types of inhibition. Allopurinol, as a transition state analog of xanthine oxidase, and acyclovir competitively inhibit the catalytic a...

H. Ojha, K. Sharma, P.K. Agrawala, S. Kallepalli, S. Raina,

Background: DNA damage is one of the major consequences of radiation exposure onto the biological systems. A series of compounds including flavanoids were found to render DNA protection against radiation damage. In this study we elucidated the potential of rutin and rutin hydrate to protect plasmid DNA against damage induced by irradiation. Materials and Methods: DPPH and hydroxyl radical scave...

2010
Prajakta Deodhar Anjali Kshirsagar

Tight Binding (TB) method was first developed by Slater and Koster[1] for band structure calculations. With the advent of nanostructures, the method is experiencing revival due to its computational speed and capability of retaining the quantum mechanical description essential for electronic structure calculations. Despite being a parametric technique, TB method has added advantage of transferab...

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