GROMACS 2025 #284
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GROMACS 2025 #284
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Build failures related to eth-cscs/alps-cluster-config#71. |
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cscs-ci run alps;system=daint;uarch=gh200;uenv=gromacs:2025 |
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cscs-ci run alps;system=eiger;uarch=zen2;uenv=gromacs:2025 |
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On Eiger we are hitting this issue: https://gitlab.com/gromacs/gromacs/-/issues/5289 |
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cscs-ci run alps;system=eiger;uarch=zen2;uenv=gromacs:2025 |
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cscs-ci run alps;system=daint;uarch=gh200;uenv=gromacs:2025 |
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Compilation test for |
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cscs-ci run alps;system=daint;uarch=gh200;uenv=gromacs:2025 |
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cscs-ci run alps;system=eiger;uarch=zen2;uenv=gromacs:2025 |
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Add GROMACS 2025 uenv with PLUMED and PyTorch.
plumed mklibworks properly)Based on #256.