GROMACS in the Cloud: A Global Supercomputer to Speed Up Alchemical Drug Design
2022 | journal article. A publication with affiliation to the University of Göttingen.
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GROMACS in the Cloud: A Global Supercomputer to Speed Up Alchemical Drug Design
Kutzner, C.; Kniep, C.; Cherian, A.; Nordstrom, L.; Grubmüller, H. ; de Groot, B. L. & Gapsys, V. (2022)
Journal of Chemical Information and Modeling, art. acs.jcim.2c00044. DOI: https://doi.org/10.1021/acs.jcim.2c00044
