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The Human Toxome Collaboratorium: A Shared Environment for Multi-Omic Computational Collaboration within a Consortium

机译:人类毒物学协作组织:财团内部进行多组计算协作的共享环境

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The Human Toxome Project is part of a long-term vision to modernize toxicity testing for the 21st century. In the initial phase of the project, a consortium of six academic, commercial, and government organizations has partnered to map pathways of toxicity, using endocrine disruption as a model hazard. Experimental data is generated at multiple sites, and analyzed using a range of computational tools. While effectively gathering, managing, and analyzing the data for high-content experiments is a challenge in its own right, doing so for a growing number of -omics technologies, with larger data sets, across multiple institutions complicates the process. Interestingly, one of the most difficult, ongoing challenges has been the computational collaboration between the geographically separate institutions. Existing solutions cannot handle the growing heterogeneous data, provide a computational environment for consistent analysis, accommodate different workflows, and adapt to the constantly evolving methods and goals of a research project. To meet the needs of the project, we have created and managed The Human Toxome Collaboratorium, a shared computational environment hosted on third-party cloud services. The Collaboratorium provides a familiar virtual desktop, with a mix of commercial, open-source, and custom-built applications. It shares some of the challenges of traditional information technology, but with unique and unexpected constraints that emerge from the cloud. Here we describe the problems we faced, the current architecture of the solution, an example of its use, the major lessons we learned, and the future potential of the concept. In particular, the Collaboratorium represents a novel distribution method that could increase the reproducibility and reusability of results from similar large, multi-omic studies.
机译:人类毒物学项目是使21世纪毒性测试现代化的长期愿景的一部分。在该项目的初始阶段,由六个学术,商业和政府组织组成的财团已合作,以内分泌干扰为模型危害,绘制了毒性途径。实验数据在多个站点生成,并使用一系列计算工具进行分析。有效地收集,管理和分析用于高含量实验的数据本身是一个挑战,但是对于越来越多的跨组学技术和跨多个机构的,具有更大数据集的复杂技术来说,这样做会使过程变得复杂。有趣的是,最困难的,持续的挑战之一是地理位置不同的机构之间的计算协作。现有解决方案无法处理不断增长的异构数据,无法提供用于一致分析的计算环境,无法容纳不同的工作流程,并且无法适应研究项目不断发展的方法和目标。为了满足项目的需求,我们创建并管理了The Human Toxome Collaboratorium,这是一个托管在第三方云服务上的共享计算环境。 Collaboratorium提供了一个熟悉的虚拟桌面,其中包含商业,开源和定制应用程序。它共享了传统信息技术的一些挑战,但云中出现了独特而出乎意料的限制。在这里,我们描述了我们面临的问题,解决方案的当前体系结构,其使用示例,我们汲取的主要经验教训以及该概念的未来潜力。特别是,Collaboratorium代表了一种新颖的分配方法,可以提高类似的大型多组学研究结果的可重复性和可重用性。

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