scholarly journals Sudėtinės geometrinės struktūros biojutiklių kompiuterinis modeliavimas

2011 ◽  
Vol 56 ◽  
pp. 156-162
Author(s):  
Romas Baronas ◽  
Karolis Petrauskas

Biojutikliai yra analitiniai įrenginiai, skirti medžiagų koncentracijoms matuoti. Kuriant naujus biojutiklius reikia atlikti daug eksperimentų. Siekiant sumažinti atliekamų fizinių eksperimentų skaičių taikomas kompiuterinis biojutiklių veiksmo odeliavimas, kai įprastai kiekvienam struktūriškai naujam biojutikliui yra sudaromas matematinis modelis, tuomet jis keičiamas skirtuminiu, o jo lygčių sistemos sprendimas įgyvendinamas sudarant kompiuterinį modelį. Kiekvienas žingsnis reikalauja atidos ir turėtų būti automatizuotas. Straipsnyje yra pateikiamas biojutiklio metamodelis, leidžiantis formuluoti biojutiklių modelius dalykinės srities sąvokomis. Pasiūlytasis metamodelis aprašo biojutiklių modelius, formuluojamus dvimatėje erdvėje, apimančius biojutiklio struktūros, jo geometrinių savybių, biojutikliuose vykstančių reakcijų ir difuzijos procesų aprašus. Sudarius metamodelį, buvo sukurta programinė įranga, automatiškai sukonstruojanti kompiuterinį biojutiklio modelį pagal metamodeliosąvokomis išreikšto biojutiklio aprašą. Metamodelis ir programinė įranga buvo taikoma realiam biojutiklio modeliui sudaryti ir jo veiksmui modeliuoti kompiuteriniu būdu.", t. y. ištrinti žodžius "biojutiklių veiksmo.Computer-Aided Modeling of Biosensors with a Complex Geometrical StructureRomas Baronas, Karolis Petrauskas SummaryBiosensors are analytical devices used to measure the concentration of substances. When developing new biosensors, a lot of experiments are needed to be performed. Mathematical modeling of biosensors is used to decrease the number of physical experiments. Models of biosensors are usually created for each structurally unique biosensor by defining its mathematical model and the corresponding numerical approximation. Equations of the numerical model are then solved using computer programs, usually created for a particular model of the biosensor. Each of these steps requires a great attention and should be automated. The article presents a metamodel for a biosensor, enabling one to define models of biosensors in domain-specific terms. The proposed metamodel describes biosensor models, defined in the two-dimensional space and including definitions of the structure of a biosensor, its geometrical properties, reactions and diffusion processes taking place in it. Upon defining the metamodel, we compiled the computer software able to create computer models for biosensors from the models formulated according to the proposed metamodel. The metamodel was practically used to define a model for a real biosensor, and the biosensor modeling software was used to simulate its operation.

2020 ◽  
pp. 3084-3092
Author(s):  
Tola John Odule ◽  
Ademola Olusola Adesina ◽  
Adebisi Khadijat-Kubrat Abdullah ◽  
Peter Ibikunle Ogunyinka

Referral techniques are normally employed in internet business applications. Existing frameworks prescribe things to a particular client according to client inclinations and former high evaluations. Quite a number of methods, such as cooperative filtering and content-based methodologies, dominate the architectural design of referral frameworks. Many referral schemes are domain-specific and cannot be deployed in a general-purpose setting. This study proposes a two-dimensional (User × Item)-space multimode referral scheme, having an enormous client base but few articles on offer. Additionally, the design of the referral scheme is anchored on the  and  articles, as expressed by a particular client, and is a combination of affiliation rules mining and the content-based method. The experiments used the dataset of MovieLens, consisting of 100,000 motion pictures appraisals on a size of 1-5, from 943 clients on 1,682 motion pictures. It utilised a five-overlap cross appraisal on a (User × Item)-rating matrix with 12 articles evaluated by a minimum of 320 clients. A total of 16 rules were generated for both  and  articles, at 35% minimum support and 80% confidence for the  articles and 50% similitude for the . Experimental results showed that the anticipated appraisals in denary give a better rating than other measures of exactness. In conclusion, the proposed algorithm works well and fits on two dimensional -space with articles that are significantly fewer than users, thus making it applicable and effective in a variety of uses and scenarios as a general-purpose utility.


Author(s):  
Chongchong Chen ◽  
Xiaoli Wu ◽  
Jie Zhang ◽  
Jingjing Chen ◽  
Xulin Cui ◽  
...  

Two-dimensional (2D) lamellar membranes are promising for efficient molecule transfer, while the underlying molecule transfer mechanism is rarely elucidated. Herein, heterostructured nanosheets are prepared by self-assembling small-sized hydrophilic cyanuric acid melamine (CMN) and hydrophobic g-C3N4 nanosheets. The resultant lamellar membranes show comparable affinity to both polar and nonpolar solvents, allowing them to dissolve on membrane surface and diffuse through membrane channels. Permeance results demonstrate that the transfer of polar solvents is controlled by dissolution and diffusion processes, while that of nonpolar solvents is governed by dissolution process. And the corresponding equations are established. Importantly, polar solvents are induced to form ordered arrangement in hydrophilic nanodomains and then maintain this state in hydrophobic nanodomains, affording low-resistance transfer thus high permeance: 1025 L m-2 h-1 bar-1 for acetonitrile. In contrast, nonpolar solvents with disordered arrangement acquire lower permeance than that of polar ones, but with comparable diffusion ability in these membranes.


2008 ◽  
Vol 42 (43) ◽  
pp. 108-113
Author(s):  
Karolis Petrauskas ◽  
Romas Baronas

Biojutikliai yra plačiai naudojami tirti medžiagų koncentracijai tirpaluose. Viena pagrindinių biojutiklio sudedamųjų dalių yra fermentas. Fermentai yra gana brangios medžiagos, dėl to ir vykdyti eksperimentus yra brangu. Kuriant naujus biojutiklius tenka atlikti daug eksperimentų. Kad būtų sumažintas reikiamų eksperimentų skaičius, taikomas kompiuterinis biojutiklių veiksmo modeliavimas. Dažniausiai konkrečios geometrijos biojutikliui kuriamas konkretus jo kompiuterinis modelis. Šiame straipsnyje pristatoma sistema, kuri gali prisitaikyti prie konkrečios geometrijos biojutiklio. Sistema gali būti taikoma biojutikliams, kurių veiksmas aprašomas matematiniais modeliais, formuluojamais dvimatėje stačiakampėje srityje. Konkretaus biojutiklio matematinio modelio sprendinys komponuojamas parenkant konkrečius algoritmus.Computer aided model composition for biosensors modelled in two-dimensional spaceKarolis Petrauskas, Romas Baronas SummaryBiosensors are analytical devices that use biological components, usually enzymes, which catalyse the interaction with a target analyte. Biosensors are widely used in clinical, environment and industrial applications for the determination of species concentrations. In some applications of biosensors, enzymes are very expensive and only available in very limited quantity. In design of novel highly sensitive biosensors a lot of experiments are required. Computer simulation of the biosensor action is an effective way to decrease a number of physical experiments. This paper presents a system adaptive to a concrete geometry of the biosensor. The system may be applied for biosensors, the action of which can be described by a mathematical model formulated in a two dimensional space. A simulator for a concrete biosensor is generated from the detailed description of the biosensor action.eight: 18px;"> 


Author(s):  
Petro Kostrobij ◽  
Iryna Ryzha

In the paper a study of a two-dimensional mathematical model of carbon monoxide oxidation on the Pt catalyst surface according to the Langmuir-Hinshelwood mechanism is presented. This model takes into account the nanoinhomogeneities of Pt(110) surface and diffusion processes of CO molecules and oxygen atoms adsorbed on the catalyst surface. It is shown that the structural changes of Pt(110) surface significantly affect the character of oscillatory mode of reaction, whereas the adsorbed oxygen atoms can be considered immobile.


1976 ◽  
Vol 32 ◽  
pp. 109-116 ◽  
Author(s):  
S. Vauclair

This paper gives the first results of a work in progress, in collaboration with G. Michaud and G. Vauclair. It is a first attempt to compute the effects of meridional circulation and turbulence on diffusion processes in stellar envelopes. Computations have been made for a 2 Mʘstar, which lies in the Am - δ Scuti region of the HR diagram.Let us recall that in Am stars diffusion cannot occur between the two outer convection zones, contrary to what was assumed by Watson (1970, 1971) and Smith (1971), since they are linked by overshooting (Latour, 1972; Toomre et al., 1975). But diffusion may occur at the bottom of the second convection zone. According to Vauclair et al. (1974), the second convection zone, due to He II ionization, disappears after a time equal to the helium diffusion time, and then diffusion may happen at the bottom of the first convection zone, so that the arguments by Watson and Smith are preserved.


1980 ◽  
Vol 41 (C6) ◽  
pp. C6-28-C6-31 ◽  
Author(s):  
R. Messer ◽  
H. Birli ◽  
K. Differt

2020 ◽  
pp. 130-135
Author(s):  
D.N. Korotaev ◽  
K.N. Poleshchenko ◽  
E.N. Eremin ◽  
E.E. Tarasov

The wear resistance and wear characteristics of cluster-gradient architecture (CGA) nanostructured topocomposites are studied. The specifics of tribocontact interaction under microcutting conditions is considered. The reasons for retention of high wear resistance of this class of nanostructured topocomposites are studied. The mechanisms of energy dissipation from the tribocontact zone, due to the nanogeometry and the structural-phase structure of CGA topocomposites are analyzed. The role of triboactivated deformation and diffusion processes in providing increased wear resistance of carbide-based topocomposites is shown. They are tested under the conditions of blade processing of heat-resistant titanium alloy.


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