48 citations · 64 across the 2 of their papers we have counts for
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cs.SE2016
Designing Workflow Systems Using Building Blocks
Matteo Turilli, Andre Merzky, Vivek Balasubramanian +2
We suggest there is a need for a fresh perspective on the design and development of workflow systems and argue for a building blocks approach. We outline a description of this appr…
cs.CE2016
ExTASY: Scalable and Flexible Coupling of MD Simulations and Advanced Sampling Techniques
Vivekanandan Balasubramanian, Iain Bethune, Ardita Shkurti +5
For many macromolecular systems the accurate sampling of the relevant regions on the potential energy surface cannot be obtained by a single, long Molecular Dynamics (MD) trajector…