COVID CPU (GRO_A7) projects 14363, 14364 to ADV

[vvoelz]

These are high-priority drug screening simulations related to the COVID Moonshot project (https://covid.postera.ai/covid)

14363 - FEP screening of protease inhibitors in complex (MOONSHOT 1-500 LR)
Project description here: https://apps.foldingathome.org/project.py?p=14363
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14364 - FEP screening of protease inhibitors in solution (MOONSHOT 1-500 L)
Project description here: https://apps.foldingathome.org/project.py?p=14364
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For 14364, there is a limit of nCPUs <= 12 since the box of solvent is small, and the calculation won't parallelize efficiently.

CORONAVIRUS PROJECT

These projects are part of Folding@home’s efforts to assist researchers around the world taking up the global fight against COVID-19. At the time of release, this is the latest news update: https://foldingathome.org/2020/03/10/covid19-update/

These are CPU projects to simulate COVID-19 proteins to learn about their dynamics and function. These supplement high-priority GPU projects of the main protease as well as the COVID-19 receptor binding domains. All can be considered potential drug targets.

Please stay tuned to https://foldingathome.org/news/ for more current updates.