based on the fact the manipulation of fine nanoclusters calls for more precise modeling, the aim of this paper is to conduct an atomistic investigation for interaction analysis of particle-substrate system for pushing and positioning purposes. in the present research, 2d molecular dynamics simulations have been used to investigate such behaviors. performing the planar simulations can provide a ...

in statistical quality control a very widely used measure is average run length (arl) which may be worked out by different methods like integral equation, approximations, and monte carlo simulations. the arl measure and the other related measures are of major significance in every type of production process. an omission in its computation (and hence its related measures such as extra quadratic ...

the molecular dynamics (md) simulation method is used to assess structural details for humanprion protein (hereafter prpn) and its asp178 asn mutant (hereafter prpm) which causes fatalfamilial insomnia disease. the results reveal that the flexibility and instability increase in prpmcould be related to specific amino acids exposed to the solvent. solvation free energy of prpm is 20kjmot1nni2 mor...

Since tubes are widely used for different industrial applications, processing of tubes by the Severe Plastic Deformation (SPD) method has been the target of different attempts. Among these attempts, development of SPD processes for tubes based on Equal Channel Angular Pressing (ECAP) has been more successful. As an illustration, Tube Channel Pressing (TCP) has been presented as an attractive SP...

Climate changes caused by global warming has presented challenges to human society. Studying the Changes of climate variables in the future decades by using output data’s of Atmosphere-Ocean Global Circulation Models (AOGCM) is a way of perusing climate fluctuation in a region. In this study, the focus is on the AOGCM proceeds in simulating of variable temperature in Ahwaz and Abadan stations. ...

serum albumin is the most aboundant protein in blood plasma. its two major roles aremaintaining osmotic pressure and depositing and transporting compounds. in this paper,albumin-methanol solution simulation is carried out by three techniques including montecarlo (mc), molecular dynamic (md) and langevin dynamic (ld) simulations. byinvestigating energy changes by time and temperature (between 27...