Carsten Kutzner, Christian Kniep, Austin Cherian, Ludvig Nordstrom, Helmut Grubmüller, Bert L. de Groot, Vytautas Gapsys. GROMACS in the Cloud: A Global Supercomputer to Speed Up Alchemical Drug Design. Journal of Chemical Information and Computer Sciences, 62(7):1691-1711, 2022. [doi]
Abstract is missing.