Efficient Molecular Dynamics simulations with GROMACS on LUMI

By |June 30, 2023|Categories: Latest News, Main Post, Success stories|

(The post appeared first on https://www.csc.fi/-/efficient-molecular-dynamics-simulations-on-lumi, courtesy of Rasmus [...]

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Webinar: GROMACS-PMX for accurate estimation of free energy differences (2023-06-20)

By |May 29, 2023|Categories: Latest News, Webinars|

View slides on Zenodo Abstract Accurate estimation of free energy [...]

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