International Workshop on Science Gateways

Session

Paper Session 4

4 Jun 2013, 11:05

ML Building, Room F34 (ETH Zurich)

Conveners

Paper Session 4

• Richard Sinnott (University of Melbourne)

12. Orbital analysis of oxo and peroxo dicopper complexes via quantum chemical workflows in MoSGrid

Alexander Hoffmann (Ludwig-Maximilians-Universität München)

04/06/2013, 11:05

The science gateway MoSGrid (Molecular Simulation Grid) is a valuable tool to submit and process molecular simulation studies on a large scale. An orbital analysis of oxo and peroxo dicopper complexes, which are bioinspired models of tyrosinase, is presented as a real-world chemical example. The orbital analysis is result of a quantum chemical workflow which has been employed on several...

13. On the equivalence of specific control flow and data flow patterns with use cases

Akos Balasko (MTA SZTAKI)

04/06/2013, 11:30

Although many of workflow languages use workflow patterns in various aspects such as control or data, the implementation of these patterns are quite different, which makes the workflow language interoperability really difficult. This paper introduces compositions of specific data and control patterns and then proves their equivalence, which benefits that control structures can be replaced by...

14. A Model-based Information Security Risk Assessment method for Science Gateways

Evert Mouw (Academic Medical Center of University of Amsterdam)

04/06/2013, 11:55

BACKGROUND: Information Security is important for e-Science research groups and other small organisations that design and operate science gateways and virtual research environments, especially when such environments are being used for (bio)medical research. We propose a novel method to do risk assessments: MISRAM, the Model-based Information Security Risk Assessment Method. It uses an...