نتایج جستجو برای: molecular structural mechanics
تعداد نتایج: 1118852 فیلتر نتایج به سال:
Cells establish and modulate their morphology and mechanics through the use of structural networks whose components range in size from a few nanometers to tens of micrometers. Over the past two decades, an exciting suite of sophisticated microand nanoscale technologies has emerged that permits investigators to directly probe structural and functional contributions of these components in living ...
in this paper we have focused on the dielectric constant effect between various solvents with theoretical modelin the biochemical process. thereby, aaa, uuu, aag and uuc triplex sequences have been optimized inwater, methanol, ethanol and dmso with proposed scrf model of theory. the solvation of biomolecules isimportant in molecular biology since numerous processes involve to interacting a prot...
The basics of quantum mechanics and statistical thermodynamics were used to predict the potential energy and intermolecular forces of asphaltene molecules. The parameters associated with the chemical structure were also estimated for a specific asphaltene molecule to predict the Mie potential function. Based on the structural results, a new form of the Virial EOS with Peneloux correction wa...
advanced technologies in molecular biology and modern experimental biophysics heavily rely not only on the knowledge of structure of essential proteins but also on their structural dynamics. the function of these bimolecular systems and the pathways along which the biological phenomena take place can be determined based on the knowledge of the molecular structure and behavior. as such, the simp...
Most reservoir fluids contain heavy paraffinic compounds that may precipitate as a solid or solid like material called wax if the fluid is cooled down. Wax precipitation is a phenomenon of considerable importance in oil industry. An increase in aggregation results in enhanced oil viscosity. This however causes significant negative effects on production, transportation and processing of crude oi...
This study investigates propagation of mode I crack in B70 pre-stressed concrete sleepers by fracture mechanics approach. A new experimental analysis is done for notched B70 pre-stressed concrete sleepers with Replica test and image analysis. A scanning electron microscope test (SEM) and an image analysis are applied for the Replica test in order to determine crack length and crack mouth openin...
A promising approach to developing improved potential functions for modeling macromolecular interactions consists of combining protein structural analysis, quantum mechanical calculations on small molecule models, and molecular mechanics potential decomposition. Here we apply this approach to the interactions of pairs of ring-containing amino acids in proteins. We find reasonable qualitative ag...
The annual production of 260 Gtonnes of oxygen, during the process of photosynthesis, sustains life on earth. Oxygen is produced in the thylakoid membranes of green-plant chloroplasts and the internal membranes of cyanobacteria by photocatalytic water oxidation at the oxygen-evolving complex (OEC) of photosystem II (PSII). Recent breakthroughs in X-ray crystallography and advances in quantum me...
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