Statistical Analysis and Parameter Selection for Mapper

In this article, we study the question of the statistical convergence of the 1-dimensional Mapper to its continuous analogue, the Reeb graph. We show that the Mapper is an optimal estimator of the Reeb graph, which gives, as a byproduct, a method to automatically tune its parameters and compute confidence regions on its topological features, such as its loops and flares. This allows to circumvent the issue of testing a large grid of parameters and keeping the most stable ones in the brute-force setting, which is widely used in visualization, clustering and feature selection with the Mapper.Comment: Minor modification

Computational Processes and Incompleteness

We introduce a formal definition of Wolfram's notion of computational process based on cellular automata, a physics-like model of computation. There is a natural classification of these processes into decidable, intermediate and complete. It is shown that in the context of standard finite injury priority arguments one cannot establish the existence of an intermediate computational process

Application of optimization techniques to vehicle design: A review

The work that has been done in the last decade or so in the application of optimization techniques to vehicle design is discussed. Much of the work reviewed deals with the design of body or suspension (chassis) components for reduced weight. Also reviewed are studies dealing with system optimization problems for improved functional performance, such as ride or handling. In reviewing the work on the use of optimization techniques, one notes the transition from the rare mention of the methods in the 70's to an increased effort in the early 80's. Efficient and convenient optimization and analysis tools still need to be developed so that they can be regularly applied in the early design stage of the vehicle development cycle to be most effective. Based on the reported applications, an attempt is made to assess the potential for automotive application of optimization techniques. The major issue involved remains the creation of quantifiable means of analysis to be used in vehicle design. The conventional process of vehicle design still contains much experience-based input because it has not yet proven possible to quantify all important constraints. This restraint on the part of the analysis will continue to be a major limiting factor in application of optimization to vehicle design

Predicting Skin Permeability by means of Computational Approaches : Reliability and Caveats in Pharmaceutical Studies

© 2019 American Chemical Society.The skin is the main barrier between the internal body environment and the external one. The characteristics of this barrier and its properties are able to modify and affect drug delivery and chemical toxicity parameters. Therefore, it is not surprising that permeability of many different compounds has been measured through several in vitro and in vivo techniques. Moreover, many different in silico approaches have been used to identify the correlation between the structure of the permeants and their permeability, to reproduce the skin behavior, and to predict the ability of specific chemicals to permeate this barrier. A significant number of issues, like interlaboratory variability, experimental conditions, data set building rationales, and skin site of origin and hydration, still prevent us from obtaining a definitive predictive skin permeability model. This review wants to show the main advances and the principal approaches in computational methods used to predict this property, to enlighten the main issues that have arisen, and to address the challenges to develop in future research.Peer reviewedFinal Accepted Versio

Out of Nowhere: Spacetime from causality: causal set theory

This is a chapter of the planned monograph "Out of Nowhere: The Emergence of Spacetime in Quantum Theories of Gravity", co-authored by Nick Huggett and Christian W\"uthrich and under contract with Oxford University Press. (More information at www.beyondspacetime.net.) This chapter introduces causal set theory and identifies and articulates a 'problem of space' in this theory.Comment: 29 pages, 5 figure

Transitions in spatial networks

Networks embedded in space can display all sorts of transitions when their structure is modified. The nature of these transitions (and in some cases crossovers) can differ from the usual appearance of a giant component as observed for the Erdos-Renyi graph, and spatial networks display a large variety of behaviors. We will discuss here some (mostly recent) results about topological transitions, `localization' transitions seen in the shortest paths pattern, and also about the effect of congestion and fluctuations on the structure of optimal networks. The importance of spatial networks in real-world applications makes these transitions very relevant and this review is meant as a step towards a deeper understanding of the effect of space on network structures.Comment: Corrected version and updated list of reference

Development of a Reverse Engineered, Parameterized, and Structurally Validated Computational Model to Identify Design Parameters that Influence American Football Faceguard Performance

Traumatic brain injury (TBI) continues to have the greatest incidence among athletes participating in American football. The headgear design research community has focused on developing accurate computational and experimental analysis techniques to better assess the ability of headgear technology to attenuate impacts and protect athletes from TBI. Despite efforts to innovate the headgear system, minimal progress has been made to innovate the faceguard. Although the faceguard is not the primary component of the headgear system that contributes to impact attenuation, faceguard performance metrics, such as weight, structural stiffness, and visual field occlusions, have been linked to athlete safety. To improve upon the understanding of the discrepancies in faceguard performance metrics, this research developed reverse engineered, structurally validated, and parameterized finite element (FE) simulations of common American football faceguards. The reverse engineered, FE simulation validation, and parametric analysis process was repeated for a total of nine common American football faceguards spanning four style categories, four helmet-compatible series, and three equipment manufacturers. The results comparing the faceguard models indicated measured responses—mass and stiffness—varied across faceguard styles and helmet-compatible series. Additionally, this work developed the Central Visual Field – Occlusion (CVF-O) metric and the Peripheral Visual Field – Occlusion (PVF-O) metric which quantified the amount of occlusion from each faceguard in each of the hypothesized segments of the visual field. The comparison of the nine faceguards modeled indicated a large difference in faceguard styles and helmet-compatible series; however, the results were not correlated to faceguard style, mass, or structural stiffness. Leveraging the results from the parametric analysis, an “overbuilt” faceguard was reverse engineered and modeled. The metal wire cross-sections were parameterized as an ellipse, and the mass of the overbuilt faceguard was minimized subject to stress and stiffness constraints. When comparing the models of the original manufacturer’s designs with two materials, the masses and structural stiffnesses were directly proportional to the densities and elastic moduli of the two materials. Both innovating the metal wire cross section and changing material properties have demonstrated the potential to improve upon faceguard performance metrics