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. 2022 Jan 17;8:817175. doi: 10.3389/fmolb.2021.817175

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Copyright © 2022 Baskaran, Craft, Eghbalnia, Gryk, Hoch, Maciejewski, Schuyler, Wedell and Wilburn.

This is an open-access article distributed under the terms of the Creative Commons Attribution License (CC BY). The use, distribution or reproduction in other forums is permitted, provided the original author(s) and the copyright owner(s) are credited and that the original publication in this journal is cited, in accordance with accepted academic practice. No use, distribution or reproduction is permitted which does not comply with these terms.

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Schematic representation of the NMRbox platform from an end-user and software developer perspective. Solid lines illustrate direct services available to users and developers, while dotted lines represent services that are available transparently through connections controlled by the NMRbox infrastructure. Users connect to NMRbox PaaS VMs (production or custom built) through VNC which provides a full GUI desktop environment or ssh for a command-line interface. The NMRbox website provides users the ability to check the status of VMs, start and end VNC sessions, help documentation, and a complete software listing with version information. File transfers are performed via ssh (scp/sftp) or the NMRbox Globus institutional endpoint. All NMRbox VMs (production, custom, and downloadable) are provisioned with software from the NMRbox software developer repository. All PaaS VMs are backed by significant computational resources and storage appliances in the HPC datacenter.