GrayWulf Cluster for Dynameomics Analysis

The Daggett Group and other labs are working with Microsoft External Research to create a GrayWulf cluster optimized to analyze their Dynameomics data. Read more about the project in this report from Microsoft and on the msdn eScience blog.

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The Dynameomics Project, which began running on the supercomputers at NERSC in 2005 with the goal of simulating the unfolding pathways of all known protein folds, was listed as a major accomplishment in Advanced Scientific Computing Research at Lawrence Berkeley National Lab.

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Publication: Beck et al. in PNAS, 2008

The group’s recent paper, “The intrinsic conformational propensities of the 20 naturally occurring amino acids and reflection of these propensities in proteins” published in PNAS, was highlighted by both NewsRX and Pharmacy Choice. Beck D.A.C., Alonso D.O.V., Inoyama D., and Daggett V. The intrinsic conformational propensities of the 20 naturally occurring amino acids and reflection of these propensities in…

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Daggett Group Featured in Microsoft Case Study

June 2008 Microsoft featured the Group’s integration of Windows software in a Case Study in June of 2008. High-performance computing clusters running Windows Compute Cluster Server are used to run the lab’s molecular dynamics software with better performance than the optimized Linux version, and Microsoft SQL Server powers the 14-terabyte Dynameomics Database. The group’s application of Microsoft’s…

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