1,378 research outputs found

    Research into container reshuffling and stacking problems in container terminal yards

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    Container stacking and reshuffling are important issues in the management of operations in a container terminal. Minimizing the number of reshuffles can increase productivity of the yard cranes and the efficiency of the terminal. In this research, the authors improve the existing static reshuffling model, develop five effective heuristics, and analyze the performance of these algorithms. A discrete-event simulation model is developed to animate the stacking, retrieving, and reshuffling operations and to test the performance of the proposed heuristics and their extended versions in a dynamic environment with arrivals and retrievals of containers. The experimental results for the static problem show that the improved model can solve the reshuffling problem more quickly than the existing model and the proposed extended heuristics are superior to the existing ones. The experimental results for the dynamic problem show that the results of the extended versions of the five proposed heuristics are superior or similar to the best results of the existing heuristics and consume very little time

    学校カウンセリング実践に関する一考察(2)

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    application/pdf大阪府立大学紀要(人文・社会科学). 1997, 45, p.69-80departmental bulletin pape

    Measurement of the e+e-→D(*)+D(*)- cross sections

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    journal articl

    Studying the Collective Functional Response of a Receptor in Alchemical Ligand Binding Free Energy Simulations with Accelerated Solvation Layer Dynamics

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    Ligand binding free energy simulations (LB-FES) that involve sampling of protein functional conformations have been longstanding challenges in research on molecular recognition. Particularly, modeling of the conformational transition pathway and design of the heuristic biasing mechanism are severe bottlenecks for the existing enhanced configurational sampling (ECS) methods. Inspired by the key role of hydration in regulating conformational dynamics of macromolecules, this report proposes a novel ECS approach that facilitates binding-associated structural dynamics by accelerated hydration transitions in combination with the λ-exchange of free energy perturbation (FEP). Two challenging protein–ligand binding processes involving large configurational transitions of the receptor are studied, with hydration transitions at binding sites accelerated by Hamiltonian-simulated annealing of the hydration layer. Without the need for pathway analysis or ad hoc barrier flattening potential, LB-FES were performed with FEP/λ-exchange molecular dynamics simulation at a minor overhead for annealing of the hydration layer. The LB-FES studies showed that the accelerated rehydration significantly enhances the collective conformational transitions of the receptor, and convergence of binding affinity calculations is obtained at a sweet-spot simulation time scale. Alchemical LB-FES with the proposed ECS strategy is free from the effort of trial and error for the setup and realizes efficient on-the-fly sampling for the collective functional response of the receptor and bound water and therefore presents a practical approach to high-throughput screening in drug discovery

    Sensitivity analysis for significant metabolites on CKD.

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    Sensitivity analysis for significant metabolites on CKD.</p

    A generic implementation of replica exchange with solute tempering (REST2) algorithm in NAMD for complex biophysical simulations

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    Abstract Replica Exchange with Solute Tempering (REST2) is a powerful sampling enhancement algorithm of molecular dynamics (MD) in that it needs significantly smaller number of replicas but achieves higher sampling efficiency relative to standard temperature exchange algorithm. In this paper, we extend the applicability of REST2 for quantitative biophysical simulations through a robust and generic implementation in greatly scalable MD software NAMD. The rescaling procedure of force field parameters co... Title of program: REST2-NAMD Catalogue Id: AEXX_v1_0 Nature of problem A generic implementation providing user-friendly API including input file preparation and performing replica exchange, and high frequency exchange attempt frequency with minimal communication overhead. Versions of this program held in the CPC repository in Mendeley Data AEXX_v1_0; REST2-NAMD; 10.1016/j.cpc.2015.08.030 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018

    Data_Sheet_1_Air Pollution, Foreign Direct Investment, and Mental Health: Evidence From China.ZIP

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    Recently, there has been interest in the relationship between mental health and air pollution; however, the results are inconsistent and the contribution of foreign direct investment (FDI) has received little attention. This article studies the effects of air pollution on mental health and the moderating role of FDI based on the China Health and Retirement Longitudinal Study (CHARLS) data in 2015 and 2018 applying the fixed effects panel regression approach and the threshold model. The results show that mental health is adversely affected by air pollution, especially PM2.5, PM10, sulfur dioxide (SO2), carbon monoxide (CO), and nitrogen dioxide (NO2). Second, FDI has an alleviating influence on the negative relationship. Third, the effects of air pollution and FDI are heterogeneous based on regional characteristics, including location, medical resource and investment in science and technology, and individual characteristics covering education level, age, income, and physical health. Finally, the threshold effects show that FDI has a moderating effect when it is >1,745.59 million renminbi (RMB). There are only 11.19% of cities exceeding the threshold value in China. When the value of air quality index (AQI) exceeds 92.79, air pollution is more harmful to mental health. Government should actively introduce high-quality FDI at the effective level and control air pollution to improve mental health.</p

    Exposure-CKD-clumped selected SNP.

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    BackgroundChronic Kidney Disease (CKD) represents a global health challenge, with its etiology and underlying mechanisms yet to be fully elucidated. Integrating genomics with metabolomics can offer insights into the putatively causal relationships between serum metabolites and CKD.MethodsUtilizing bidirectional Mendelian Randomization (MR), we assessed the putatively causal associations between 486 serum metabolites and CKD. Genetic data for these metabolites were sourced from comprehensive genome-wide association studies, and CKD data were obtained from the CKDGen Consortium.ResultsOur analysis identified four metabolites with a robust association with CKD risk, of which mannose and glycine showed the most reliable causal relationships. Pathway analysis spotlighted five significant metabolic pathways, notably including "Methionine Metabolism" and "Arginine and Proline Metabolism", as key contributors to CKD pathogenesis.ConclusionThis study underscores the potential of certain serum metabolites as biomarkers for CKD and illuminates pivotal metabolic pathways in CKD’s pathogenesis. Our findings lay the groundwork for potential therapeutic interventions and warrant further research for validation.</div
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