• 제목/요약/키워드: transition state

검색결과 1,895건 처리시간 0.029초

Comparison between Parametric and Semi-parametric Cox Models in Modeling Transition Rates of a Multi-state Model: Application in Patients with Gastric Cancer Undergoing Surgery at the Iran Cancer Institute

  • Zare, Ali;Mahmoodi, Mahmood;Mohammad, Kazem;Zeraati, Hojjat;Hosseini, Mostafa;Naieni, Kourosh Holakouie
    • Asian Pacific Journal of Cancer Prevention
    • /
    • 제14권11호
    • /
    • pp.6751-6755
    • /
    • 2013
  • Background: Research on cancers with a high rate of mortality such as those occurring in the stomach requires using models which can provide a closer examination of disease processes and provide researchers with more accurate data. Various models have been designed based on this issue and the present study aimed at evaluating such models. Materials and Methods: Data from 330 patients with gastric cancer undergoing surgery at Iran Cancer Institute from 1995 to 1999 were analyzed. Cox-Snell Residuals and Akaike Information Criterion were used to compare parametric and semi-parametric Cox models in modeling transition rates among different states of a multi-state model. R 2.15.1 software was used for all data analyses. Results: Analysis of Cox-Snell Residuals and Akaike Information Criterion for all probable transitions among different states revealed that parametric models represented a better fitness. Log-logistic, Gompertz and Log-normal models were good choices for modeling transition rate for relapse hazard (state $1{\rightarrow}state$ 2), death hazard without a relapse (state $1{\rightarrow}state$ 3) and death hazard with a relapse (state $2{\rightarrow}state$ 3), respectively. Conclusions: Although the semi-parametric Cox model is often used by most cancer researchers in modeling transition rates of multistate models, parametric models in similar situations- as they do not need proportional hazards assumption and consider a specific statistical distribution for time to occurrence of next state in case this assumption is not made - are more credible alternatives.

Effect of control route on the unstart/restart characteristics of an over-under TBCC inlet

  • Li, Nan;Chang, Juntao;Tang, Jingfeng;Yu, Daren;Bao, Wen;Song, Yanping
    • Advances in aircraft and spacecraft science
    • /
    • 제5권4호
    • /
    • pp.431-444
    • /
    • 2018
  • Numerical simulations have been conducted to study the unstart/restart characteristics of an over-under turbine-based combined-cycle propulsion system (TBCC) inlet during the inlet transition phase. A dual-solution area exists according to the Kantrowitz theory, in which the inlet states may be different even with the same input parameters. The entire transition process was divided into five stages and the unstart/restart hysteresis loop for each stage was also obtained. These loops construct a hysteresis surface which separates the operating space of the engine into three parts: in which a) inlet can maintain a started state; b) inlet keeps an unstarted state; c) inlet state depends on its initial state. During the transition, the operation of the engine follows a certain order with different backpressures and splitter angles, namely control route, which may result in disparate inlet states. Nine control routes with different backpressures and transition stages were designed to illuminate the route-dependent behavior of the inlet. The control routes operating towards the unstart boundary can make the inlet transit from a started state into an unstarted one. But operating backward the same route cannot make the inlet restart, additional effort should be made.

분지 특성을 고려한 초전도 전류도입선 설계 (Design of Superconducting Current Leads Considering Bifurcation Characteristic)

  • 설승윤
    • 한국초전도ㆍ저온공학회논문지
    • /
    • 제1권2호
    • /
    • pp.37-42
    • /
    • 1999
  • The stability of high-temperature superconducting current leads for cryogenic devices are investigated. By assuming full transition from superconducting state to normal state at a transition temperature, the HTS current at a transition temperature, the HTS current lead shows bifurcation phenomenon. There is a bifurcation shape-factor, HTS leads have three steady state. Below the bifurcation shape-factor, the superconducting current lead is unconditionally stable, because there exists only one steady-factor HTS current lead is conditionally stable depending on the shape and intensity of disturbance.

  • PDF

Molecular Spinless Energies of the Morse Potential Energy Model

  • Jia, Chun-Sheng;Cao, Si-Yi
    • Bulletin of the Korean Chemical Society
    • /
    • 제34권11호
    • /
    • pp.3425-3428
    • /
    • 2013
  • We solve the Klein-Gordon equation with the Morse empirical potential energy model. The bound state energy equation has been obtained in terms of the supersymmetric shape invariance approach. The relativistic vibrational transition frequencies for the $X^1{\sum}^+$ state of ScI molecule have been computed by using the Morse potential model. The calculated relativistic vibrational transition frequencies are in good agreement with the experimental RKR values.

Theoretical Study of the Hydroalumination Reaction of Cyclopropane with Alane

  • Singh, Satya Prakash;Thankachan, Pompozhi Protasis
    • 대한화학회지
    • /
    • 제57권2호
    • /
    • pp.216-220
    • /
    • 2013
  • The hydroalumination of cyclopropane has been investigated using the B3LYP density functional method employing several split-valence basis sets. It is shown that the reaction proceeds via an intermediate weakly bound complex and a four-centered transition state. Calculations at higher levels of theory were also performed at the geometries optimized at the B3LYP level, but only slight changes in the barriers were observed. Structural parameters for the transition state are also reported.

Simulation Study for Performance Measures of Resources in a Port Container Terminal

  • Choi, Yong-Seok
    • 한국항해항만학회지
    • /
    • 제28권7호
    • /
    • pp.587-591
    • /
    • 2004
  • In order to measure the performance of resources in a port container terminal, we conducted a state transition network simulation to model various equipment processes. The processes that container cranes and transfer cranes perform are idle, wait, move, and work. Vehicles perform idle, wait, empty travel, and full travel. Because cranes, vehicles, and vessels are movable entities and all equipment is classified as either a customer or server, we separated the various stages of the process based upon the state transition network To validate the simulation results, a real system was used to illustrate the use of various measurements using the state transition network.

상태 전이 모델 기반 결함 트리 분석 (Fault Tree Analysis based on State-Transition Model)

  • 정인상
    • 한국콘텐츠학회논문지
    • /
    • 제11권10호
    • /
    • pp.49-58
    • /
    • 2011
  • 결함 트리 분석(Fault Tree Analysis)은 결함 트리를 구축하여 시스템의 안전성 분석을 수행한다. 그러나 결함 트리를 구성하는 작업은 대상 시스템의 도메인에 대한 지식과 경험을 필요로 하며 많은 시간과 노력을 소요한다. 이 논문에서는 시스템 설계 산출물인 상태 전이 모델을 기반으로 결함 트리를 체계적으로 구성하는 방법을 제안한다. 이를 위해 시스템 상태 전이 모델의 안정성 확보에 필요한 조건들을 식별하고 결함 트리를 구성할 수 있는 템플리트를 개발한다. 이 논문에서는 제안된 방법을 철도 건널목 제어 시스템에 적용한 결과도 기술한다.

Tightness of the Transition State for the Reactions of Secondary Alkyl Arenesulfonates with Anilines in Acetonitrile

  • 오혁근;권영봉;정동수;이익춘
    • Bulletin of the Korean Chemical Society
    • /
    • 제16권9호
    • /
    • pp.827-831
    • /
    • 1995
  • Kinetic studies on the reactions of five secondary acylic alkyl arenesulfonates with anilines are carried out in acetonitrile at 65.0 ℃. The magnitude of ρXZ determined (ρXZ=0.12-0.13) is slightly greater than that for the alicyclic series (ρXZ=0.11) under the same experimental condition. Ab initio MO results are found to support the slightly tighter transition state expected from the greater magnitude of ρXZ for the acyclic series. Despite the small variations, the magnitude of ρXZ and the theoretical transition state tightness remain relatively constant for the secondary carbon centers. Secondary kinetic isotope effects involving deuterated aniline nucleophiles show a successively smaller kH/kD(<1.0) value for a more sterically crowded reaction center carbon. This is in accord with the later transition state for bond-making predicted by the Bell-Evans-Polanyi principle for the more endothermic nucleophilic substitution reaction. Further support is provided by the results of the AM1 MO calculations on the reactions of secondary alkyl benzenesulfonates with chloride nucleophile.

Correlation Between Cross Interaction Constant and Bond Length in the S$_N$2 Transition State

  • Lee, Ik-Choon
    • Bulletin of the Korean Chemical Society
    • /
    • 제9권3호
    • /
    • pp.179-182
    • /
    • 1988
  • A simple correlation between cross interaction constants ${\rho}_{ij}$ and bond lengths in the transition state was obtained ; it has been shown that ${\rho}_{ij}$ corresponds to force constant of activation, which in turn is related to bond length by Badger's rule involving only universal constants. A satisfactory correlation between 4-31G ab initio calculated values of bond length and force constant for C-X streching in the transition state of the methyl transfer reaction, $X^-\;+\;CH_3X\;=\;XCH_3\;+\;X^-$, indicated that Badger's rule can be extended to bonds in the transition state. Independence of ${\rho}_{ij}$ values from the variable charge transmission of reaction centers has been demonstrated with nearly constant, experimentally determined I${\rho}$XYI values, and hence similar degree of bond formation, for various $S_N2$ reactions.

Bifurcation analysis of budding yeast cell cycle

  • Nguyen, Cuong;Yoon, Chang-No;Kim, Hak-Yong;Han, Seung-Kee
    • 한국생물정보학회:학술대회논문집
    • /
    • 한국생물정보시스템생물학회 2004년도 The 3rd Annual Conference for The Korean Society for Bioinformatics Association of Asian Societies for Bioinformatics 2004 Symposium
    • /
    • pp.50-56
    • /
    • 2004
  • Bifurcation analysis of cell cycle regulation in the budding yeast is performed basedon the mathematical model by Chen et al [Molecular biology of cell, 11:369-391, 2000]. On the bifurcation diagram, locations of both stable and unstable solutions of the nonlinear differential equations are presented by taking the mass of cell as a controlparameter. Based on the bifurcation diagram, dynamic mechanism underlying the 'start' transition, initiation of a new round of cell cycle, and the 'finish' transition, completion of cell cycle and returning back to the initial state, is discussed: the 'start' transition is a transition from a stable fixed solution for a small mass and to an oscillatory state for a large mass, and the 'finish' transition is a switching back to the stable fixed solution from the oscillatory state. To understand the role of the genes during the cell cycle regulation, bifurcation diagrams for the mutants are compared with that of the wild type.

  • PDF