Molecular parameter optimization gateway (ParamChem): workflow management through TeraGrid ASTA

Jayeeta Ghosh, Suresh Marru, Nikhil Singh, Kenno Vanomesslaeghe, Ye Fan, Sudhakar Pamidighantam. Molecular parameter optimization gateway (ParamChem): workflow management through TeraGrid ASTA. In John Towns, Shawn Brown, Daniel S. Katz, editors, Proceedings of the 2011 TeraGrid Conference - Extreme Digital Discovery, TG '11, Salt Lake City, Utah, USA, July 18-21, 2011. ACM, 2011. [doi]

Abstract

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