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In this article, we present a new LINear Constraint Solver (LINCS) for molecular simulations with bond constraints. The algorithm is inherently stable, as the constraints themselves are reset instead of derivatives of th...

Summary We propose the elastic net, a new regularization and variable selection method. Real world data and a simulation study show that the elastic net often outperforms the lasso, while enjoying a similar sparsity of r...

Abstract Assuming that numerical scores are available for the performance of each of n persons on each of n jobs, the “assignment problem” is the quest for an assignment of persons to jobs so that the sum of the n sc...

Designing complex, dynamic yet multi-functional materials and devices is challenging because the design spaces for these materials have numerous interdependent and often conflicting constraints. Taking inspiration from a...

A nonlinear (nonconvex) programming model provides a new definition of efficiency for use in evaluating activities of not-for-profit entities participating in public programs. A scalar measure of the efficiency of each p...

The particle swarm is an algorithm for finding optimal regions of complex search spaces through the interaction of individuals in a population of particles. This paper analyzes a particle's trajectory as it moves in disc...

Variable selection is fundamental to high-dimensional statistical modeling, including nonparametric regression. Many approaches in use are stepwise selection procedures, which can be computationally expensive and ignore ...

This paper describes a computational approach to edge detection. The success of the approach depends on the definition of a comprehensive set of goals for the computation of edge points. These goals must be precise enoug...

Materias / palabras clave: optimization, computer science, mathematics, algorithms; Science: Mathematics

Materias / palabras clave: data science and analytics, exact algorithms, mathematical models, innovative applications, rigorous methods, validating experiments; Technology: Technology (General): Industrial engineering. Management engineering: Appl...