the aim of this study is investigating the transport mechanism of ibuprofen chiral isomers inside singlewall carbon nano tube (swcnt) using mathematical modeling. to achieve this goal, molecular dynamicssimulation has been performed to evaluate the interactions of ibuprofen isomers with swcnt in an aqueoussolution. results show that both chiral forms of ibuprofen molecules enter and remain insi...

Both system dynamics (SD) and discrete-event simulation (DES) are used to help understand and explain puzzling real world dynamics. But what are the similarities and differences between these two approaches and which should be used in a specific circumstance? These are questions few have ventured to answer. In this research the two approaches are compared by developing an SD and DES model of th...

This paper describes a novel simulation framework that integrates discreteevent modeling with system-dynamics modeling. The former has strength in system performance evaluation; meanwhile, the later has an advantage of representing feedback mechanisms in complex systems. We are currently developing a hybrid-modeling framework, which combines discrete-event modeling with system dynamics modeling...

this work deals with effects of asymmetric stiffness on the dynamic behaviour of the rotor system. the analysis is presented through an extended lagrangian hamiltonian mechanics on the asymmetric rotor system, where symmetries are broken in terms of the rotor stiffness. the complete dynamics of asymmetries of rotor system is investigated with a case study. in this work, a mathematical model is ...

The numerical simulation of granular systems of even moderate size is a challenging computational problem. In most investigations, either Molecular Dynamics or Event-driven Molecular Dynamics is applied. Here we show that in certain cases, mainly (but not exclusively) for static granular packings, the Bottom-to-top Reconstruction method allows for the efficient simulation of very large systems....

The paper considers event-triggered leader-follower tracking control for multi-agent systems with general linear dynamics. For both undirected and directed follower graphs, we propose event triggering rules which guarantee bounded tracking errors. With these rules, we also prove that the systems do not exhibit Zeno behavior, and the bounds on the tracking errors can be tuned to a desired small ...

With advances in computational power, the rapidly growing role of computational/simulation methodologies in the physical sciences, and the development of new human-computer interaction technologies, the field of interactive molecular dynamics seems destined to expand. In this paper, we describe and benchmark the software algorithms and hardware setup for carrying out interactive molecular dynam...