Traditional drug design requires a great amount of research time and developmental
expense. Booming computational approaches, including computational biology, computer …

Metal ions play significant roles in biological systems. Accurate molecular dynamics (MD)
simulations on these systems require a validated set of parameters. Although there are more …

K-means algorithm is one of the most famous unsupervised clustering algorithms. Many
theoretical improvements for the performance of original algorithms have been put forward …

The characterization of nonlinear dynamical systems and their attractors in terms of invariant
measures, basins of attractions and the structure of their vector fields usually outlines a task …

Electronic structure theory (especially quantum chemistry) has thrived and has become
increasingly relevant to a broad spectrum of scientific endeavors as the sophistication of …

Aldose reductase reduces glucose to sorbitol. It plays a key role in many of the
complications arising from diabetes. Thus, aldose reductase inhibitors (ARI) have been …

The Graphics Processing Unit (GPU) is a powerful tool for parallel computing. In the past
years the performance and capabilities of GPUs have increased, and the Compute Unified …

Terminal guidance of autonomous parafoils is a difficult problem in which wind uncertainty
and system underactuation are major challenges. Existing strategies almost exclusively use …

Abstract The Compute Unified Device Architecture (CUDA) programming language on a
graphics processing unit (GPU) is exploited to develop a GPU-based simulation program for …

Today's graphics processing units (GPU) have tremendous resources when it comes to raw
computing power. The simulation of large groups of agents in transport simulation has a …