• 제목/요약/키워드: Energy Informatics

검색결과 114건 처리시간 0.024초

Understanding Rifampicin Resistance in Tuberculosis through a Computational Approach

  • Kumar, Satish;Jena, Lingaraja
    • Genomics & Informatics
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    • 제12권4호
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    • pp.276-282
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    • 2014
  • The disease tuberculosis, caused by Mycobacterium tuberculosis (MTB), remains a major cause of morbidity and mortality in developing countries. The evolution of drug-resistant tuberculosis causes a foremost threat to global health. Most drug-resistant MTB clinical strains are showing resistance to isoniazid and rifampicin (RIF), the frontline anti-tuberculosis drugs. Mutation in rpoB, the beta subunit of DNA-directed RNA polymerase of MTB, is reported to be a major cause of RIF resistance. Amongst mutations in the well-defined 81-base-pair central region of the rpoB gene, mutation at codon 450 (S450L) and 445 (H445Y) is mainly associated with RIF resistance. In this study, we modeled two resistant mutants of rpoB (S450L and H445Y) using Modeller9v10 and performed a docking analysis with RIF using AutoDock4.2 and compared the docking results of these mutants with the wild-type rpoB. The docking results revealed that RIF more effectively inhibited the wild-type rpoB with low binding energy than rpoB mutants. The rpoB mutants interacted with RIF with positive binding energy, revealing the incapableness of RIF inhibition and thus showing resistance. Subsequently, this was verified by molecular dynamics simulations. This in silico evidence may help us understand RIF resistance in rpoB mutant strains.

MiRPI: Portable Software to Identify Conserved miRNAs, Targets and to Calculate Precursor Statistics

  • Vignesh, Dhandapani;Parameswari, Paul;Im, Su-Bin;Kim, Hae-Jin;Lim, Yong-Pyo
    • Genomics & Informatics
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    • 제9권1호
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    • pp.39-43
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    • 2011
  • MicroRNAs (miRNAs) are recently discovered small RNA molecules usually resulting in translational repression and gene silencing. Despite the fact that specific cloning of small RNA's is a method in practice, computational identification of miRNA's has been a major focus recent days, since is a rapid process following AB initio and sequence alignment methods. Here we developed new software called MiRPI that aims to identify the highly conserved miRNAs without any mismatches from given fasta formatted gene sequences by using non-repeated miRNA dataset of the user's interest. The new window embedded with the software is used to identify the targets for inputted mature miRNAs in the mRNA sequences. Also MiRPI is designed to measure the precursor miRNA statistics, majorly focusing the Adjusted Minimum Folding free Energy (AMFE) and Minimum Folding free Energy Index (MFEI), the most important parameters in miRNA confirmation. MiRPI is developed by PERL (Practical Extraction and Report Language) and Tk (Tool kit widgets) scripting languages. It is user friendly, portable offline software that works in all windows OS, sized to 3 MB.

In Silico Study of Human Gap Junction Beta-2 Protein by Homology Modeling

  • Shehzadi, Abida;Masood, Khalid
    • Genomics & Informatics
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    • 제8권2호
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    • pp.70-75
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    • 2010
  • Asp66his, Asp54Lys, and Asp50Asn are mutations in connexin 26 that are observed in the clinic and give rise to autosomal dominant syndromes. They are the result of point mutations in the human gap junction ${\beta}-2$ gene. In order to investigate the structural mechanism of Bart-Pumphrey Syndrome, Keratitis-Ichthyosis-Deafness Syndrome, and Vohwinkel Syndrome, homology modeling was carried out. Asp66 has direct contact with Asn62 by two hydrogen bonds in the wild-type protein, and in Asp66His, the biggest change observed is a tremendous energy increase caused by hydrogen bond breakage to Asn62. Shifts in the side chain and new hydrogen bond formation are observed for Lys54 compared to the wild-type protein (Asn54) and result in closer contact to Val84. Asp50Asn causes a significant decrease in bond energy, and residual charge reversal repels the ion and metabolites and, hence, inhibits their transportation. Such perturbations are likely to be a factor contributing to abnormal functioning of ion channels, resulting cell death and disease.

Effective Validation Model and Use of Mobile-Health Applications for the Elderly

  • Lopez, Leonardo Juan Ramirez;Pinto, Edward Paul Guillen;Linares, Carlos Omar Ramos
    • Healthcare Informatics Research
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    • 제24권4호
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    • pp.276-282
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    • 2018
  • Objectives: Due to the uncontrolled increase of the mobile health applications and their scarce use by elderly for reason of absence credibility of measurements by lack scientific support, the aim of this study was to evaluate the differences between the biophysical measurements based on standard instrument against a mobile application using controlled experiments with elderly to propose an effective validation model of the developed apps. Methods: The subjects of the study (50 people) were elderly people who wanted to check their weight and cardiac status. For this purpose, two mobile applications were used to measure energy expenditure based on physical activity (Activ) and heart rate (SMCa) during controlled walking at specific speeds. Minute-by-minute measurements were recorded to evaluate the average error and the accuracy of the data acquired through confidence intervals by means of statistical analysis of the data. Results: The experimental results obtained by the Activ/SMCa apps showed a consistent statistical similarity with those obtained by specialized equipment with confidence intervals of 95%. All the subjects were advised and trained on the use of the applications, and the initial registration of data to characterize them served to significantly affect the perceived ease of use. Conclusions: This is the first model to validate a health-app with elderly people allowed to demonstrate the anthropometric and body movement differences of subjects with equal body mass index (BMI) but younger. Future studies should consider not only BMI data but also other variables, such as age and usability perception factors.

Bacterial $\beta$-Glucan Exhibits Potent Hypoglycemic Activity via Decrease of Serum Lipids and Adiposity, and Increase of UCP mRNA Expression

  • HONG KYUNGHEE;JANG KI-HYO;LEE JAE-CHEOL;KIM SOHYE;KIM MI-KYOUNG;LEE IN-YOUNG;KIM SANG-MOO;LIM YOONG HO;KANG SOON AH
    • Journal of Microbiology and Biotechnology
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    • 제15권4호
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    • pp.823-830
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    • 2005
  • This study was undertaken to evaluate the effect of bacteria-derived $\beta$-glucan fiber on serum lipids, adiposity and uncoupling protein (UCP) expression in rats. In order to induce obesity, Sprague-Dawley weanling male rats were allowed free access to AIN-76A diet until 4 weeks of age, and fed high-fat diet (beef tallow, $40\%$ of calories as fat) for 6 weeks until 10 weeks of age. Rats were then fed with $0\%$ thigh- fat control group), $1\%$, or $5\%$ bacterial ~-glucan supplemented high-fat diets (w/w) for another 6 weeks. For comparison, normal control group was fed with AIN-76 diet $11.7\%$ fat). Supplementation with bacterial $\beta$-glucan resulted in a significant reduction of high-fat-induced white fat (i.e., visceral and peritoneal fat) development, adipocyte hypertrophy, and development of hyperinsulinemia and hyperleptinemia. Serum triglyceride, total cholesterol, and free fatty acid levels were greatly reduced, but, HDL-cholesterol concentrations were increased by bacterial $\beta$-glucan supplementation. Serum leptin level was lower in the $\beta$-glucan groups than in the high-fat group. The expression of UCPs (UCP1, UCP2, and UCP3) in brown adipose tissue (BAT) were significantly increased by $5\%$ bacterial $\beta$-glucan-containing diet. This study suggests that the anti-obesity effect of $5\%$ bacterial $\beta$-glucan is attributed to upregulation of UCPs and inefficient energy utilization.

변증옥함(辨證玉函) 권사(卷四) 진증가증변(眞症假症辨)에 대(對)한 연구(硏究) (A Study on Jin Jeung Ga Jeung Byun of the Byun Jeung Ok Ham(辨證玉函))

  • 서종철;박동석;금경수
    • 대한한의정보학회지
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    • 제16권2호
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    • pp.9-49
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    • 2010
  • Byun Jeung Ok Ham, written by Jin Sa Tak is composed of four books. This book is estimated of being written after A.D 1688 and composed of internal medicine, obstetrics and gynecology, ophthalmology, dental surgery and so on, total 36 parts of clinical medicine. This is the last book of that four studying about definition on true and false of 15 diseases. 15 subjects follow, tumo, heat, faint, hematemesis and nosebleeding, insanity, great vomiting, great diarrhea, great thirst, scrotal hernea, uterus attacked by heat, dysentery, congestion, great swelling, malaria, attack by cold. This treatise is the last book of four which deals with jin ga translating into korean and studying about medical theories. In every parts, author's unique clinical theory appears affluently and in that periods his study developed a lot in those days' medical methods. The first book deals with eum yang. second book is weakness and strongness, third upper and low, fourth truth and untruth. First book, Jin Sa Tak says studying on eum yang is oriental medical basic theory and on incurable diseases or chronic symptoms, doctor must go back to that eumyang demonstration after can cure patients. Second parts are on weakness and strongness demonstration, that weakness is weakness of patients' energy and strongness is prosperous condition of diseases' attack. Third parts are on upper and low, that upper is upper parts of human body of painful parts and low is human low parts of pain, that is parts of under waist. And this treaties fourth parts are truth and untruth, true symptoms and untrue symptoms, that is the real reaction of human condition and the other way. Every prescriptions are author's creations. This book provides new viewpoints which surpasses original ancient medical theories. Author suggests new opinions about chronic and incurable diseases.

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상용승용차 시트프레임 부품의 중량 최적화에 관한 연구 (A Study on the Weight Optimization for the Passenger Car Seat Frame Part)

  • 장인식;민병조
    • 한국자동차공학회논문집
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    • 제14권5호
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    • pp.155-163
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    • 2006
  • Car seat is one the most important element to make comfortable drivability. It can absorb the impact or vibration during driving state. In addition to those factors, it is needed to have enough strength for passenger safety. From energy efficiency and environmental point of view lighter passenger car seat frame becomes hot issue in the auto industry. In this paper, weight optimization methodology is investigated for commercial car seat frame using CAE. Optimized designs for seat frame are developed using commercially available finite element code(ANSYS) and design of experiment method. At first, car seat frame is modelled using 3-D computer aided design tool(CATIA) and simplified for finite element modelling. Finite element analysis is carried out for the case of FMVSS 202 Head Restraint test to check the strength of the original seat frame. Two base brackets are selected as optimized elements that are the heaviest parts in the seat frame. After finite element analysis for the brackets with similar load condition to the previous test optimization technique is applied for 10% to 50% weight reduction. Design of experiment is utilized to obtain optimization design for the bracket based on the modified 50% weight reduction model in which outer shape of the bracket is conserved. Weight optimization models result in the decrease of the strength in spite of weight reduction. The more design points should be considered to get better optimized model. The more advanced optimization technique may be utilized for more parts of the seat frame to increase whole seat frame characteristics in the future.

INVESTIGATION OF THE COHERENT WAVE PACKET FOR A TIME-DEPENDENT DAMPED HARMONIC OSCILLATOR

  • CHOI JEONG RYEOL;CHOI S. S.
    • Journal of applied mathematics & informatics
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    • 제17권1_2_3호
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    • pp.495-508
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    • 2005
  • We investigated both classical and quantum properties of a damped harmonic oscillator with a time-variable elastic coefficient using invariant operator method. We acquired the energy eigenvalues, uncertainties and probability densities for several types of wave packet. The probability density corresponding to the displaced minimum wave packet expressed in terms of the time-dependent Gaussian function. The displaced minimum wave packet not only be attenuated but also oscillates about x = 0. We confirmed that there exist correspondence between quantum and classical behaviors for the time-dependent damped harmonic oscillator.

DYNAMIC AUTOCORRELATION TEMPERATURE MODELS FOR PRICING THE WEATHER DERIVATIVES IN KOREA

  • Choi, H.W;Chung, S.K
    • Journal of applied mathematics & informatics
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    • 제9권2호
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    • pp.771-785
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    • 2002
  • Many industries like energy, utilities, ice cream and leisure sports are closely related to the weather. In order to hedge weather related risks, they invest their assets with portfolios like option, coupons, future, and other weather derivatives. Among weather related derivatives, CDD and HDD index options are mainly transacted between companies. In this paper, the autocorrelation system of temperature will be checked for several cities in Korea and the parameter estimation will be carried based on the maximum likelihood estimation. Since the log likelihood increase as the number of parameters increases, we adopt the Schwarz information criterion .

Interpretation of Association Networks among Protein Sequence Motifs

  • Kam, Hye J.;Lee, Junehawk;Lee, Doheon;Lee, Kwang H.
    • Genomics & Informatics
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    • 제1권2호
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    • pp.75-79
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    • 2003
  • Every protein can be characterized by either a distinct motif or a combination of motifs. Nevertheless, little is known about the relationships among (more than two) the motifs. Some of the proteins in the world are share motifs for evolutional or other biological benefits - they can save energy, time and resource for controlling and managing a variety of proteins. In some cases of motifs, the tendency is quite common and they can act the 'hub' motif of a network of the motif associations. The hubs are structurally and functionally important in themselves and also important in disease-related mutations. They will be highly resistant mutation to conserve their functions. But, in case of the a rare mutation, mutations on the position of hub can more easily cause fatal diseases.